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Heterocyclic compound

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Organic compound » Heterocyclic compound
Collapsed list Selected category: Heterocyclic compound with all child subcategories
Total count of records found: 1001. Showed records: 20.

541. Thermopsine

Molecular formula: C15H20N2O CAS# 53584-33-1
Categories: Alkaloid
CB31229265
Names
English:
Thermopsine
;
N/\|`/`\`|`\`/`/|N`/|O`|`\`||/\\|0\/</>`|`\
N-<\\O>/`\\`-`//\`/`-`-`/`-`\/-N<\>/-<->\`/
|N`/|O`|`\`||/\\_(A-15,L2.4):a_(A10,L1.5)_(A60)N_(a-40)_p6_p6_p6_p6<_p6>_(A-150,L1.8)<_(A-100,L2)_#a>_(A135,L1.5)_#N
N`/|O`|`\`||/\\|_q8-:a_q8`|N</\|`/`\>_q8`-<_q8>_(A45,L1.5)_#a

542. (+)-Thermopsine

Molecular formula: C15H20N2O CAS# 486-90-8
Categories: Alkaloid
ChemSpider ID: 553790 | CHEMBL1324708
Names
English:
(+)-Thermopsine
;
(7α,9α)-3,4,5,6-Tetradehydrospartein-2-one(IUPAC)
;
7,14-Methano-2H,11H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-11-one, 1,3,4,6,7,13,14,14a-octahydro-(CAS)
;
7,14-Methano-2H,11H-dipyrido[1,2-a:1',2'-e][1,5]diazocin-11-one, 1,3,4,6,7,13,14,14a-octahydro-, (7R,14R,14aS)-(CAS)
;
7,14-Methano-4H,6H-dipyrido[1,2-a:1',2'-E][1,5]diazocin-4-one, 7,7a,8,9,10,11,13,14-octahydro-, [7R-(7α,7aα,14α)]-
;
|N`/|O`|`\`||/\\_(A-15,L2.4):a_(A10,L1.5)_(A60)N_(a-40)_p6_p6_p6_p6<_p6><_(a-120,d+)H>_(A-150,L1.8)<_(A-100,L2)_#a_(A-60,w+)H><|dH>_(A135,L1.5)_#N
N/\|`/`\<|dH>`|`\`/<`|wH>`/|N`/|O`|`\`||/\\|0\/</><|dH>`|`\

543. Dihydrobenzofuran

Molecular formula: C8H8O CAS# 496-16-2
Categories: Heterocyclic compounds (2 rings)
PubChem CID: 10329 | ChemSpider ID: 21106522 | CHEMBL370688 | MolPort-000-146-048 | CB6272979
Names
English:
2,3-Dihydro-1-benzofuran(IUPAC)
;
2,3-Dihydrobenzofuran
;
2,3-dihydro-1-benzo[b]furan
;
2,3-dihydrobenzo[b]furan
;
Benzofuran, 2,3-dihydro-(CAS)
;
Coumaran
;
Dihydrobenzofuran
;
EINECS:207-817-3
;
cumaran
;
dihydrobenzo[b]furan
;
`/`\\`|//\||_qO_q_q_q
`//`\`||/\\|_q_q_qO_q

544. Desmodin

Molecular formula: C22H22O6 CAS# 56257-27-3
Categories: Pterocarpans
PubChem CID: 13338925 | LipidMAPS: LMPK12070104 | CB22521310
Names
English:
(7aR,12aα)-7a,12a-Dihydro-9,13-dimethoxy-3,3-dimethyl-3H,7H-benzofuro[3,2-c]pyrano[3,2-g][1]benzopyran-10-ol
;
Desmodin
;
`-_q<_pp6_p6<_q6HO>_pp6<_q6O_p6>_p6_pp6>_qO_q_q_p6_p6O_p6_p6_q6<_p6O_q6>_qq6_p6_qq6_q6<_(a90)><_(a30)>_q6O_q6<_q6>_pp6_q6_q6_p6
O`|/`|`\O`/|`/<|O\>`\\``/`\\`|<`-><_(a-30)>/O\<|>//\|\/0\|<_#1>\\/<\OH>`||</O\>`\`//

545. Nitron

Molecular formula: C20H16N4 CAS# 2218-94-2
Categories: Heterocyclic compound
PubChem CID: 720071 | CB6459107 | NSC 5038 | MolPort-027-837-944 | MolPort-002-904-681 | MolPort-002-130-338
Names
English:
(1,4-Diphenyl-1H-1,2,4-triazol-4-ium-3-yl)(phenyl)azanide(IUPAC)
;
(1,4-Diphenyl-4H-1,2,4-triazol-1-ium-3-yl)(phenyl)azanide
;
(1,4-diphenyl-1,2,4-triazol-4-ium-3-yl)-phenylazanide(IUPAC)
;
(5Z)-2,4-Diphenyl-5-(phenylimino)-2,5-dihydro-1,2,4-triazol-4-ium-1-ide
;
1H-1,2,4-Triazolium, 1,4-diphenyl-3-(phenylamino)-, inner salt(CAS)
;
1H-1,2,4-triazolium, 2,3-dihydro-1,4-diphenyl-3-(phenylimino)-, inner salt, (3Z)-
;
4,5-Dihydro-2,4-diphenyl-5-(phenylamino)-1H-1,2,4-triazolium Hydroxide Inner Salt
;
4H-1,2,4-triazolium, 1,4-diphenyl-3-(phenylamino)-, inner salt
;
EINECS:218-724-2
;
Nitron
;
N_(A0)N_qq<_(a54)N^-_p6_p6_qq6_q6_qq6_q6_qq6>_qN^+<_(a54)_p6_qq6_q6_qq6_q6_qq6>_qq_q_(a54)_p6_qq6_q6_qq6_q6_qq6
`-N`^-_qN<_(a54)_p6_qq6_q6_qq6_q6_qq6>_q_qqN^+<_(a54)_qq6_p6_pp6_p6_pp6_p6>_q_(a54,N2)N_q6_q6_pp6_p6_pp6_p6_pp6

546. Creatinine

Molecular formula: C4H7N3O CAS# 60-27-5
Categories: Heterocyclic compound
PubChem CID: 588 | ChemSpider ID: 568 | CHEBI:16737 | CHEMBL65567 | MolPort-001-779-735 | MolPort-003-803-357 | NSC 13123 | CB8672212
Names
English:
2-Amino-1-methyl-1,5-dihydro-4H-imidazol-4-one(IUPAC)
;
2-Amino-1-methyl-1,5-dihydroimidazol-4-one
;
2-amino-1-methylimidazolin-4-one
;
2-amino-3-methyl-4H-imidazol-5-one(IUPAC)
;
2-imino-1-methylimidazolidin-4-one
;
4H-Imidazol-4-one, 2-amino-1,5-dihydro-1-methyl-(CAS)
;
Creatinine [Wiki]
;
EINECS:200-466-7
;
|<_(a54,N2)O>_qN<_(y.5)H>_q<=NH>_qN<_(a54)CH3>_q
N|_q<_(a54,N2)O>_qN_qq<_(a54)NH2>_q_(a54)H3C
N`-<_(a54,N2)O>_q_qN<|>_q<_(a54)NH2>_qq
N`|<_(a54)NH2>_qqN_q<`=O>_q_q_(a54)

547. Troxerutin

Molecular formula: C33H42O19 CAS# 7085-55-4
Categories: Glycoside , Pharmaceutical drug , Flavonoid
PubChem CID: 5486699 | ChemSpider ID: 4589027 | CHEMBL3182320 | MolPort-003-939-710 | CB2317568
Names
English:
2-[3,4-Bis(2-hydroxyethoxy)phenyl]-3-[[6-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]oxy]-5-hydroxy-7-(2-hydroxyethoxy)-4H-1-benzopyran-4-one
;
2-[3,4-Bis(2-hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-4-oxo-4H-chromen-3-yl 6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside(IUPAC)
;
2-[3,4-bis(2-hydroxyethoxy)phenyl]-5-hydroxy-7-(2-hydroxyethoxy)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one(IUPAC)
;
4H-1-Benzopyran-4-one, 2-[3,4-bis(2-hydroxyethoxy)phenyl]-3-[[6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-5-hydroxy-7-(2-hydroxyethoxy)-(CAS)
;
7,3',4'-Tris[O-(2-hydroxyethyl)]rutin
;
EINECS:230-389-4
;
Posorutin
;
Troxerutin [Wiki]
;
\\/`||</O\/\OH>`\<`|O/`|/OH>`//|`/|`/|O`|`\`//<|OH>`\`||<`\O`/`\`/HO>/\\<|>/O\|_(A40)O_(A15)_(x%a:.6,y-%h:1.2)<_(A165)HO>_(x%b:1.6,y%d:.4)<_(A-60)OH>_(x%c:1.4,y-%d)<_(A15)OH>_(x-%a,y%h,w+)<_(x-%b,y-%d,w2)O_(x-%c,y%d,w-)>_(A-15)\O|_(x-%c,y%d)O_(x-%b,y-%d)<_(A165)H3C>_(x-%a,y%h)<_(A-165)HO>_(x%c,y-%d,w+)<_(A120)HO>_(x%b,y%d,w2)<|OH>_(x%a,y-%h,w-)
\\/<\O/\/OH>`||</O\/\OH>`\`//|`/|`/|O`|`\`//<|OH>`\`||<`\O`/`\`/HO>/\\<|>/O\|\O_(A45,L1.4,w-)/<`|dOH>\</wOH>|<\dOH>`/<`\O`|>|w`/O_(A-150,w-)`|O`\<`|dCH3>`/<`\wHO>|<`/dHO>\<|dOH>/
`/`\\`|<`\O`/`\`/HO>//<`|O/`|/OH>\||\|\|O`|/\\<|OH>/`||</O\/\OH>`\`//<|>`\O`/|`/O_(y1,d-)`/<`\wHO>|<`/dHO>\<|wOH>/<`|O`\>\d|O_(A30,d-)|<`/wHO>\<|wOH>/<\dOH>`|</w>`\O`/

548. Melamine

Molecular formula: C3H6N6 CAS# 108-78-1
Categories: Amine , Heterocyclic compound
PubChem CID: 7955 | ChemSpider ID: 7667 | CHEBI:27915 | CHEMBL1231106 | MolPort-001-792-089 | CB6324023 | NSC 2130
Names
English:
1,3,5-Triazine-2,4,6-triamine(IUPAC)
;
1,3,5-triazine-2,4,6(1H,3H,5H)-triimine(CAS)
;
1,3,5-triazine-2,4-diamine, 1,6-dihydro-6-imino-
;
6-Imino-1,6-dihydro-1,3,5-triazine-2,4-diamine
;
EINECS:203-615-4
;
Melamine [Wiki]
;
NH2|\\N|<\NH2>`//N`\<`/H2N>`||N/
H\N</H>|`//N|<`/N<`\H>|H>\\N/<\N<|H>/H>`||N`\

549. Aflatoxin G1

Molecular formula: C17H12O7 CAS# 1165-39-5
Categories: Heterocyclic compound , Ketone , Lactone , Ether , Mycotoxins
PubChem CID: 14421 | SCHEMBL50772 | ChemSpider ID: 2006508 | CHEBI:80706
Names
English:
5-(methyloxy)-3,4,7a,10a-tetrahydro-1H,12H-furo[3',2':4,5]furo[2,3-h]pyrano[3,4-c]chromene-1,12-dione
;
AFG1
;
Aflatoxin G1
;
EINECS:214-615-9
;
`|O`\`|`\``|O/`|O|\|\/`|O`\`|O|`/|`/|`/`\\`|<//>_q_q<_qO_q>_pO_p_pp_p
CH3`/O`\`|`\`|O/`|O|\|\/`|O`\`|O|`/|`/`\`/|_pO_p_p<_(a-10,d+)H><_q_qq_qO_q_(a120,d+)H>_p|\//

550. Ergotamine

Molecular formula: C33H35N5O5 CAS# 113-15-5
Categories: Alkaloid , Organic compound
PubChem CID: 8223 | ChemSpider ID: 7930 | CB2865180 | CHEBI:64318 | CHEMBL442
Names
English:
(5'α)-5'-Benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman(IUPAC)
;
(6aR,9R)-N-[(2R,5S,10aS,10bS)-5-Benzyl-10b-hydroxy-2-methyl-3,6-dioxooctahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]chinolin-9-carboxamid
;
(6aR,9R)-N-[(2R,5S,10aS,10bS)-5-Benzyl-10b-hydroxy-2-methyl-3,6-dioxooctahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinoline-9-carboxamide
;
(6aR,9R)-N-[(2R,5S,10aS,10bS)-5-benzyl-10b-hydroxy-2-méthyl-3,6-dioxooctahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-7-méthyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinoléine-9-carboxamide
;
(8β)-N-[(2R,5S,10aS,10bS)-5-Benzyl-10b-hydroxy-2-methyl-3,6-dioxooctahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-6-methyl-9,10-didehydroergoline-8-carboximidic acid(IUPAC)
;
EINECS:206-835-9
;
Ergate
;
Ergoline-8-carboximidic acid, 9,10-didehydro-6-methyl-N-[(2R,5S,10aS,10bS)-octahydro-10b-hydroxy-2-methyl-3,6-dioxo-5-(phenylmethyl)-8H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-, (8β)-(CAS)
;
Ergomar
;
Ergostat
;
Ergotaman, 12'-hydroxy-2'-methyl-3',6',18-trioxo-5'-(phenylmethyl)-, (5'α)-(CAS)
;
Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'- (phenylmethyl)-, (5'α)-
;
Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'α)-
;
Ergotaman-3',6',18-trione, 9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-, (5'α,10α)-
;
Ergotamine [Wiki]
;
Femergin
;
Gynergen
;
Lingran
;
Secagyn
;
Secupan
;
\|N<\>`/|`/<_(A110,N2):a>`\`/`\`||/\\<|`/_(A70)HN_#a>/<\`|wH>`||/`|w`\O\/N:b; N`|_qO_q<`\d#b_(y-.5)H><`/w>_q<_(a54,N2)O>_q\<|d`/\`//`-`\\/=>/\O`\`|N`\<_p_p_p_p><|wH>`/`|dHO
CH3_(y1.2,w-)|<_(A135,N2)O>_(x$3)N\<|d\/\\|`//`\`||>/\O`\`|N`\<|wH><`|_(x$3)|`/>`/<|><`|dOH>`\O`/_(A-155,d+,L1.2)N<_(y-.5)H>_(A155,L1.2)`\O\_(y1,w-)\|N<\CH3>`/|`/`\`//<|HN_(x$3)`||>`\`||/\\<|>/<\c\wH>`||/

551. Ergometrine

Molecular formula: C19H23N3O2 CAS# 60-79-7
Categories: Alkaloid , Organic compound
PubChem CID: 443884 | ChemSpider ID: 391970 | CB9498097 | CHEBI:4822 | CHEMBL119443
Names
English:
(6aR,9R)-N-[(2S)-1-Hydroxy-2-propanyl]-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinoline-9-carboxamide
;
(6aR,9R)-N-[(2S)-1-hydroxypropan-2-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide(IUPAC)
;
(8β)-N-[(2S)-1-Hydroxy-2-propanyl]-6-methyl-9,10-didehydroergoline-8-carboxamide(IUPAC)
;
(8β)-N-[(2S)-1-Hydroxy-2-propanyl]-6-methyl-9,10-didehydroergoline-8-carboximidic acid(IUPAC)
;
(8β)-N-[(2S)-1-Hydroxy-2-propanyl]-6-méthyl-9,10-didehydroergoline-8-carboxamide
;
(8β)-N-[(2S)-1-Hydroxypropan-2-yl]-6-methyl-9,10-didehydroergoline-8-carboxamide
;
Basergin
;
D-Lysergic Acid L-2-Propanolamide
;
D-Lysergic acid-L-propanolamide
;
EINECS:200-485-0
;
Ergobasin
;
Ergobasine
;
Ergoklinine
;
Ergoline-8-carboxamide, 9,10-didehydro-N-[(1S)-2-hydroxy-1-methylethyl]-6-methyl-, (8β)-(CAS)
;
Ergoline-8-carboximidic acid, 9,10-didehydro-N-[(1S)-2-hydroxy-1-methylethyl]-6-methyl-, (8β)-(CAS)
;
Ergoline-8-β-carboxamide, 9,10-didehydro-N-((S)-2-hydroxy-1-methylethyl)-6-methyl-
;
Ergometrin
;
Ergometrina
;
Ergometrine [Wiki]
;
Ergometrinum
;
Ergostetrine
;
Ergotocine
;
Margonovine
;
Neofemergen
;
Secacornin
;
Secometrin
;
[8b(S)]-9,10-Didehydro-N-(2-hydroxy-1-methylethyl)-6-methylergoline-8-carboxamide
;
ergonovine
;
\|N<\>`/|`/<_(A110,N2):a>`\`/`\`||/\\<|`/_(A70)HN_#a>/<\`|wH>`||/`|w`\O\/NH`|<`\w>/\OH
\|N<\CH3>`/|`/`\`/`\`||/\\<|`/|HN_(x$3)`||>/<\c\wH>`||/`|w`\O\/N<_(y-.5)H>\<|dCH3>/\OH

552. Ergine

Molecular formula: C16H17N3O CAS# 478-94-4
Categories: Alkaloid , Amide
PubChem CID: 442072 | ChemSpider ID: 390611 | CB8892544 | CHEBI:4819 | CHEMBL227213
Names
English:
(6aR,9R)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide(IUPAC)
;
(8β)-6-Methyl-9,10-didehydroergoline-8-carboxamide(IUPAC)
;
9,10-Didehydro-6-methyl-ergoline-8-β-carboxamide
;
9,10-Didehydro-6-methylergoline-8b-carboxamide
;
D-Lysergamide
;
D-Lysergic acid amide
;
EINECS:207-524-0
;
Ergine [Wiki]
;
Ergoline-8-carboxamide, 9,10-didehydro-6-methyl-, (8β)-
;
Ergoline-8-β-carboxamide, 9,10-didehydro-6-methyl-
;
LSA
;
`||/<`|w/O`/`\H2N>\|N<\>`/`\`/<|`/_(A70)HN:a>`\\`/||\/\<_(A110,N2)_#a>/`|`|wH
`||/<`|w/O`/`\H2N>\|N<\CH3>`/`\`/`\\`/||\/\<||_(x-$3)HN`|/`|>/`|\wH

553. Bromocriptine

Molecular formula: C32H40BrN5O5 CAS# 25614-03-3
Categories: Alkaloid , Organobromides , Pharmaceutical drug
PubChem CID: 31101 | ChemSpider ID: 28858 | CHEBI:3181 | CHEMBL493 | CB6136426
Names
English:
(5'a)-2-Bromo-12'-hydroxy-2'-(-1-methylethyl)-5'-(2-methylpropyl)ergotaman-3',6',18-trione
;
(5'α)-2-Bromo-12'-hydroxy-5'-isobutyl-2'-isopropyl-3',6',18-trioxoergotaman(IUPAC)
;
(5'α)-2-bromo-12'-hydroxy-5'-(2-methylpropyl)-3',6',18-trioxo-2'-(propan-2-yl)ergotaman
;
(8β)-2-Bromo-N-[(2R,5S,10aS,10bS)-10b-hydroxy-5-isobutyl-2-isopropyl-3,6-dioxooctahydro-8H-[1,3]oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-6-methyl-9,10-didehydroergoline-8-carboximidic acid(IUPAC)
;
2-Bromo-a-ergokryptin
;
2-Bromoergocryptine
;
;8β)-(CAS)
;
Bromocriptine [Wiki]
;
Brotin
;
Cycloset
;
EINECS:247-128-5
;
Ergoline-8-carboximidic acid, 2-bromo-9,10-didehydro-6-methyl-N-[(2R,5S,10aS,10bS)-octahydro-10b-hydroxy-2-(1-methylethyl)-5-(2-methylpropyl)-3,6-dioxo-8H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazin-2-yl]-, (
;
Ergotaman, 2-bromo-12'-hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)-3',6',18-trioxo-, (5'α)-(CAS)
;
Ergotaman-3',6',18-trione, 2-bromo-12'-hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)-, (5'α)-
;
Ergotaman-3',6',18-trione, 2-bromo-12'-hydroxy-2'-(1-methylethyl)-5'α-(2-methylpropyl)-
;
Parlodel
;
/\N<_q_q_q_q|wH>|\O`\`/<|d\<|>/>`\N`|<`|dHO>_qO_q<_q<_(a54,N2)O>_q><_(A-120,w+)<_q6>_p6>_(A-175)N<_(y.5)H>`/`\O\_(A90,w-)\|N<\>`/|`/<_(A110,N2):a_(A60)Br>`\`|`\`//|\\<_(A70)HN_#a>/`|/<\c\wH>`||/
\|N<\CH3>`/|`/`\`/`\`||/\\<|`/|HN_(x$3)`|c|\Br>/<\c\wH>`||/`|w`\O\/N<_(y.5)H>\|<_(A110,N2)O>_(x$3)N\<|d\<|CH3>/CH3>/\O`\`|N`\<|wH><`|_(x$3)|`/>`/<|><`|dOH>`\O`/`|w<_(A-70)CH3>_(A-110)H3C

554. α-Solanine

Molecular formula: C45H73NO15 CAS# 20562-02-1
Categories: Alkaloid , Glycoside
PubChem CID: 30185 | ChemSpider ID: 28033 | CHEMBL1212997 | CB9696314
Names
English:
(2R,3R,4R,5R,6S)-2-{[(2R,3R,4S,5S,6R)-5-Hydroxy-6-(hydroxymethyl)-2-{[(2S,4aR,4bS,6aS,6bR,7S,7aR,10S,12aS,13aS,13bS)-4a,6a,7,10-tetramethyl-2,3,4,4a,4b,5,6,6a,6b,7,7a,8,9,10,11,12a,13,13a,13b,14-icosahydro-1H-naphtho[2',1':4,5]indeno[1,2-b]indolizin-2-yl]oxy}-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}tetrahydro-2H-pyran-3-yl]oxy}-6-methyltetrahydro-2H-pyran-3,4,5-triol
;
(2R,3R,4R,5R,6S)-2-{[(2R,3R,4S,5S,6R)-5-Hydroxy-6-(hydroxyméthyl)-2-{[(2S,4aR,4bS,6aS,6bR,7S,7aR,10S,12aS,13aS,13bS)-4a,6a,7,10-tétraméthyl-2,3,4,4a,4b,5,6,6a,6b,7,7a,8,9,10,11,12a,13,13a,13b,14-icosahydro-1H-naphto[2',1':4,5]indéno[1,2-b]indolizin-2-yl]oxy}-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxyméthyl)tétrahydro-2H-pyran-2-yl]oxy}tétrahydro-2H-pyran-3-yl]oxy}-6-méthyltétrahydro-2H-pyran-3,4,5-triol
;
(3β)-Solanid-5-en-3-yl 6-deoxy-β-L-mannopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-galactopyranoside(IUPAC)
;
(3β)-Solanid-5-en-3-yl-6-deoxy-β-L-mannopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-galactopyranoside
;
EINECS:243-879-8
;
Solanine [Wiki]
;
Solatunine
;
alpha-Solanine
;
α-Solanine
;
β-D-Galactopyranoside, (3β)-solanid-5-en-3-yl O-6-deoxy-β-L-mannopyranosyl-(1->2)-O-[β-D-glucopyranosyl-(1->3)]-(CAS)
;
_(x-%a:.6,y-%h:1.2)O_(x-%b:1.4,y%d:.4)<_(A-120)/OH>_(x-%c:1.2,y-%d)<_(A170)HO>_(x%a,y%h,w+)<_(A-170)HO>@:b(tx,a,n:1)<$color(blue)_(A&a,L&n,N0)"&tx"$color()>@(D-Glc,90)_(x%b,y-%d,w2)<_(A60)OH>_(x%c,y%d,w-)/O\@b(D-Gal,90)_(x-%a,y-%h,w-)<`|HO>_(x%c,y%d)<_(A-120)/OH>_(x%b,y-%d)O_(x%a,y%h):a_(x-%c,y-%d,w+)<_(x-%b,y%d,w2)>_(A60)O|_(x%c,y%d)<$color(gray)_(y1.6)$color()HO>_(x%b,y-%d)<_(A10)OH>_(x%a,y%h)<_(A-10)OH>_(x-%c,y-%d,w+)<_(A60)CH3>_(x-%b,y%d,w2)O@b(L-Rha,175,1.6)_(x-%a,y-%h,w-);`/`\<`/wO`/#a>`|/\|\\/`|`\<|dH><`/`|w>`|/\|<|dH><`/`|wH>_q_q_q<_q`|w><_(a20,d+)H>_p<_(a-54,d+)>_p_pN<_p_(a-110,d+)H>\/<\d>`|`\`/`|dH
`/O`\<`/d`\HO>`|<`\wHO>/<`|dOH>\</wOH>|\dO_(A90,d-)\<_(A-30,L1.5,w+)O_(A-90,d-)/<\wOH>`|</wOH>`\<`|dOH>`/<_(A-120,w+)>|O\>|<|wH><`/O`\<`/d`\HO>`|<`\dHO>/>\O_(A-30,w-)`|/\|<`/`\>\\/`|`\<|dH><`/`|w>`|/\|<|dH><`/`|wH>_q_q_q<_(a0,d+)H><_q_(A-110,w+)>_p<_(a-54,d+)>_p_pN<_p_(a-106,d+)H>\/<\d>`|`\`/`|dH
`|/\/`|/\|<|dH><_q_q_q<_(a15,d+)H><_q`|w>_p<_(a-54,d+)>_p_pN<_p_(a-100,d+)H>\/<\d>`|`\`/`|dH>`/<`|wH><`\|dH>|`/`\\<`|`|w>`/`\_(A150,w+)O`-`\wO`-<`\w`-HO>`/<`-wHO>\<`/wO`-`\wO`-<`\w`-HO>`/<`-dHO>\<`/wHO>-<\dOH>/>-</>\dO|`/wO|<`/d>\<|wOH>/<\dOH>`|</dOH>`\

555. Aconitine

Molecular formula: C34H47NO11 CAS# 302-27-2
Categories: Alkaloid
PubChem CID: 245005 | ChemSpider ID: 214292 | CB1343300 | CHEBI:2430 | CHEMBL1979562 | MolPort-002-527-310 | NSC 56464
Names
English:
(1a,3a,6a,14a,15a,16b)-20-Ethyl-1,6,16-trimethoxy-4-(methoxymethyl)aconitane-3,8,13,14,15-pentol 8-Acetate 14-Benzoate
;
(1α,3α,6α,14α,15α,16β)-8-Acetoxy-20-ethyl-3,13,15-trihydroxy-1,6,16-trimethoxy-4-(methoxymethyl)aconitan-14-yl benzoate(IUPAC)
;
Aconitane-3,8,13,14,15-pentol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 8-acetate 14-benzoate, (1α,3α,6α,14α,15α,16β)-(CAS)
;
Aconitine [Wiki]
;
EINECS:206-121-7
;
H_(A160,w-,L.7)`/<_(A120,w+)|O`/H3C><_(A40,d+,L.9)_(A-110,d-,L1.5)N$color(#777)<_(A-155,L.8)_(A170)$color()H3C>_(A-75,d+,L1.8):a># `\<`/dHO>`|/<`|dO`\H3C>\|_q7<|dO\CH3>_q7<_(d+)#a>_q7:b# <_(A50,w+)O_(A60)<_(a50,N2)O>_q6CH3>_q7_q7<_(A-50,L.7,w+)H><_q7_(d+)#a>_p_p<`|OH><_(x1.7,d+)</wO_(A-60)CH3>_(y#b)<\dOH>_(d-)#b>_p<_p_(A-15,L.8,w+)H>_(x1.8,d+)O\|O`|/\\/`||`\`//|
_(y1,d-)|0<|wH>`/<_(A70,w+)|O`/H3C><_(A110,d+)_(y-1.8)N</#1>`\`/H3C>`\<`/dHO>`|/<`|dO`\H3C>\|_q7<_(A100,d+)O_(A80)CH3>_q7<`\d#1>_q7<\wO|`/O/\CH3><_(A-20,L1.2):a\dOH># _q7_q7<_q7><_(A-40,w+,L.8)H>_p_p<_(a-54,w+)OH><-<\#a>/wO`\H3C>_p<_p_(A10,w+,L.8)H>_(A-20,d+,L1.6)O\|O`|/\\/`||`\`//|

556. Hydantoin

Molecular formula: C3H4N2O2 CAS# 461-72-3
Categories: Heterocyclic compound
PubChem CID: 10006 | ChemSpider ID: 9612 | CB2352752 | CHEBI:27612 | CHEMBL122334 | MolPort-001-788-370
Names
English:
2,4-(3H,5H)-Imidazoledione
;
2,4-Imidazolidinedione(IUPAC)(CAS)
;
4H-Imidazole-2,5-diol(IUPAC)(CAS)
;
Hydantoin [Wiki]
;
imidazolidine-2,4-dione(IUPAC)
;
-NH_q<_(a54,N2)O>_qN<_(y-.5)H>_q_q_(a54,N2)O
HN-_q<_(a54,N2)O>_qN<_(y-.5)H>_q<_(a54,N2)O>_q
HN-_p<_(a-54,N2)O>_pN<_(y.5)H>_p<_(a-54,N2)O>_p

557. Coniine

Molecular formula: C8H17N CAS# 458-88-8
Categories: Alkaloid
PubChem CID: 441072 | ChemSpider ID: 389878 | CHEBI:28322 | CHEMBL2287063 | CB8500935
Names
English:
(+)-Coniine
;
(2S)-2-propylpiperidine(IUPAC)
;
(S)-(+)-Coniine
;
(S)-2-Propylpiperidine
;
Conicine
;
Coniine [Wiki]
;
EINECS:207-282-6
;
Piperidine, 2-propyl-, (2S)-(CAS)
;
Piperidine, 2-propyl-, (S)-
;
H_(y-.5)N`\`|/\|<`/>\d/\CH3
H_(y.5)N`/|\/`|<`\>/w\/CH3
\N<_(y.5)H>/`|`\`/|`/w`\`/
H3C/\/`|/\|`/N<_(y.5)H>`\<_(A-30,L.6,N0)$itemColor(gray)"(S)">`\dH

558. (+)-Ketoconazole

Molecular formula: C26H28Cl2N4O4 CAS# 65277-42-1
Categories: Heterocyclic compound , Pharmaceutical drug , Organochlorides
PubChem CID: 456201 | ChemSpider ID: 401695 | CHEBI:48336 | CHEMBL75 | MolPort-003-848-307
Names
English:
(+)-Ketoconazole
;
(2R,4S)-ketoconazole
;
1-Acetyl-4-(4-{[(2R,4S)-2-(2,4-dichlorphenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin
;
1-[4-(4-{[(2R,4S)-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)-1-piperazinyl]ethanone(IUPAC)
;
1-[4-(4-{[(2R,4S)-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethanone
;
1-[4-(4-{[(4S)-2-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethanone
;
1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazin-1-yl]ethanone(IUPAC)
;
EINECS:265-667-4
;
Ethanone, 1-[4-[4-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]-1-piperazinyl]-(CAS)
;
Ketoconazole [Wiki]
;
cis-1-Acetyl-4-[4-[[2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy]phenyl]piperazine
;
/<`\\O>-N/-\N<`/`-`\>-\=/<`\\`-`//>-O_(A30)_(A-30,w-)-O_q<_(a84,d+)_q6_pp6_p6<_q6Cl>_pp6_p6<_q6Cl>_pp6><_(a24)`|N_(a-54)_ppN_p_pp_p>_qO_q_q_(A110,d+)H
`/`=`\<`-Cl>//-</Cl>\\_(A0,w-)`|O_p_p<_pO_p`/d\N-_pp_pN_pp_p>-d/O-//-\\<`/`=`\>-N/-\N<`/`-`\>-<//O>\

559. Naringin

Molecular formula: C27H32O14 CAS# 10236-47-2
Categories: Flavonoid
PubChem CID: 442428 | ChemSpider ID: 390868 | CHEBI:28819 | CHEMBL451532 | MolPort-001-742-592 | CB8288064
Names
English:
(2S)-5-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-7-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside(IUPAC)
;
(2S)-7-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-5-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one(IUPAC)
;
(2S)-Naringin
;
4H-1-Benzopyran-4-one, 7-((2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl)oxy)-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (2S)-
;
4H-1-Benzopyran-4-one, 7-[[2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (2S)-(CAS)
;
4H-1-Benzopyran-4-one, 7-[[2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-2,3-dihydro-5-hydroxy-2-(4-hydroxyphenyl)-, (S)-
;
Naringenin 7-O-[α-L-rhamnosyl-(1->2)-β-D-glucoside]
;
Naringenin 7-O-neohesperidoside
;
Naringenin 7-O-α-L-rhamnosyl-(1->2)-β-D-glucoside
;
Naringenin 7-neohesperidoside
;
Naringenin 7β-neohesperidoside
;
Naringin [Wiki]
;
Naringoside
;
`/O|<`/dH3C>\<|wOH>/<\dOH>`|</dOH>`\_(A-90,L1.5,w+)O_(A-150,L1.3,d-)`/<|wHO>`\<`/dHO>`|<`\w`/HO>/O\<|>/wO\|\/`|/O\</d\\/`||</OH>`\`//|>|`/|O`|`\`|`\`//|0\|OH
_(x-%a:1.6,y%d:.4)O_(x-%b:1.4,y-%d)<_(A165)H3C>_(x%c:.6,y%h:1.2,w+)<_(A-165)HO>_(x%a,y-%d,w2)<_(A60)HO>_(x%b,y%d,w-)<|OH>_(x-%c,y-%h)`|O_(A-120)_(x-%a,y%d,w2)<_(A-165)HO>_(x-%c,y-%h,w-)<_(A165)HO>_(x%b,y%d)<_(A-135)`|OH>_(x%a,y-%d)O_(x%c,y%h)<_(x-%b,y-%d,w+)>/O\||\<|OH>//\|O`|/`|<`\O`/<|>`\\`/>/d\\/`||</OH>`\`//|
`\O`/<`\d>|<`/wHO>\<|dOH>/<\dOH>`|/wO; \<|w#-3>/<\dOH>`|</wOH>`\<`|d/OH>`/O|`/dO`\`//`\<`/HO>`||/<\\|>`|O`\<`/|`/O/\>`|w//`|`\\<`|OH>`/||\

560. Actinidine

Molecular formula: C10H13N CAS# 524-03-8
Categories: Heterocyclic compound
PubChem CID: 68231 | ChemSpider ID: 61533 | CB6969822 | CHEBI:2443
Names
English:
(7S)-4,7-Dimethyl-6,7-dihydro-5H-cyclopenta[c]pyridine(IUPAC)
;
(S)-(-)-actidine
;
5H-2-Pyrindine, 6,7-dihydro-4,7-dimethyl-, (S)-
;
5H-Cyclopenta[c]pyridine, 6,7-dihydro-4,7-dimethyl-, (7S)-(CAS)
;
Actinidine [Wiki]
;
||_q_q_q<_(a54,w+)>_q`\`//N|\\<|>/
H3C\||\N//`|`\_p_p_p<_(a-54,d+)CH3>_p`\`/
|_q<_(a54,d+)>_q_q_q`\\<`|>`/||N\//
CH3|\\|N`//`\`|_q_q_q<_(a54,w+)H3C>_q`|/
`||/\|<\dCH3>_#1`/`\\N`|//<`|CH3>\