Chemical Compound

(4AS,6AS,6BR,8AR,9R,10S,12AR,12BR,14BS)-10-{[(2S,3R,4S,5S)-3-{[(2S,3R,4S,5S,6S)-3,5-DIHYDROXY-6-METHYL-4-{[(2S,3R,4R,5R)-3,4,5-TRIHYDROXYOXAN-2-YL]OXY}OXAN-2-YL]OXY}-4,5-DIHYDROXYOXAN-2-YL]OXY}-9-(HYDROXYMETHYL)-2,2,6A,6B,9,12A-HEXAMETHYL-1,3,4,5,6,7,8,8A,10,11,12,12B,13,14B-TETRADECAHYDROPICENE-4A-CARBOXYLIC ACID

CAS Registry Number 72629-76-6
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(4AS,6AS,6BR,8AR,9R,10S,12AR,12BR,14BS)-10-{[(2S,3R,4S,5S)-3-{[(2S,3R,4S,5S,6S)-3,5-DIHYDROXY-6-METHYL-4-{[(2S,3R,4R,5R)-3,4,5-TRIHYDROXYOXAN-2-YL]OXY}OXAN-2-YL]OXY}-4,5-DIHYDROXYOXAN-2-YL]OXY}-9-(HYDROXYMETHYL)-2,2,6A,6B,9,12A-HEXAMETHYL-1,3,4,5,6,7,8,8A,10,11,12,12B,13,14B-TETRADECAHYDROPICENE-4A-CARBOXYLIC ACID 结构式
Primary record

(4AS,6AS,6BR,8AR,9R,10S,12AR,12BR,14BS)-10-{[(2S,3R,4S,5S)-3-{[(2S,3R,4S,5S,6S)-3,5-DIHYDROXY-6-METHYL-4-{[(2S,3R,4R,5R)-3,4,5-TRIHYDROXYOXAN-2-YL]OXY}OXAN-2-YL]OXY}-4,5-DIHYDROXYOXAN-2-YL]OXY}-9-(HYDROXYMETHYL)-2,2,6A,6B,9,12A-HEXAMETHYL-1,3,4,5,6,7,8,8A,10,11,12,12B,13,14B-TETRADECAHYDROPICENE-4A-CARBOXYLIC ACID

库存
1,267 克
纯度
98.7 %
CAS
72629-76-6

化合物标识与属性

CAS
72629-76-6
PubChem CID
194458
SMILES
C[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@H](CO[C@H]2O[C@H]3CC[C@]4([C@H]([C@]3(C)CO)CC[C@@]5([C@@H]4CC=C6[C@]5(CC[C@@]7([C@H]6CC(CC7)(C)C)C(=O)O)C)C)C)O)O)O)O[C@H]8[C@@H]([C@@H]([C@@H](CO8)O)O)O)O
Canonical SMILES
C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C4[C@@H]6CC(C)(C)CC[C@]6(C(=O)O)CC[C@]45C)[C@]3(C)CO)OC[C@H](O)[C@@H]2O)[C@H](O)[C@@H](O[C@@H]2OC[C@@H](O)[C@@H](O)[C@H]2O)[C@H]1O

名称与同义词

  • Clematoside S
  • Clematoside-S
  • Prosapogenin CP6
  • Sapindoside B
  • Saponin CP6
  • AC1L4YAS
  • RefChem:126923
  • A)-23-hydroxy-3-{[
  • A-l-altropyranosyl-(1->2)-
  • DTXSID30276731
  • 72629-76-6
  • KST-1A9066
  • AR-1A4852
  • CID194458
  • ZINC256297213
  • A-d-ribopyranosyl-(1->3)-6-deoxy-
  • ACN-047576
  • A-l-arabinopyranosyl]oxy}olean-12-en-28-oic acid
  • (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-3-[(2S,3R,4S,5S,6S)-3,5-dihydroxy-6-methyl-4-[(2S,3R,4R,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
  • (3|A)-23-hydroxy-3-{[|A-d-ribopyranosyl-(1->3)-6-deoxy-|A-l-altropyranosyl-(1->2)-|A-l-arabinopyranosyl]oxy}olean-12-en-28-oic acid
  • 94271-06-4
  • Hederagenin-3-O-beta-D-ribopyranosyl-(1-3)-alpha-L-rhamnopyranosyl-(1-2)-alpha-L-arabinopyranoside
  • Olean-12-en-28-oic acid, 23-hydroxy-3-((O-beta-D-ribopyranosyl-(1-3)-O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-alpha-L-arabinopyranosyl)oxy)-, (3beta,4alpha)-
  • (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-((2S,3R,4S,5S)-3-((2S,3R,4S,5S,6S)-3,5-dihydroxy-6-methyl-4-((2S,3R,4R,5R)-3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl)oxy-4,5-dihydroxyoxan-2-yl)oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
  • (4AS,6AS,6BR,8AR,9R,10S,12AR,12BR,14BS)-10-{[(2S,3R,4S,5S)-3-{[(2S,3R,4S,5S,6S)-3,5-DIHYDROXY-6-METHYL-4-{[(2S,3R,4R,5R)-3,4,5-TRIHYDROXYOXAN-2-YL]OXY}OXAN-2-YL]OXY}-4,5-DIHYDROXYOXAN-2-YL]OXY}-9-(HYDROXYMETHYL)-2,2,6A,6B,9,12A-HEXAMETHYL-1,3,4,5,6,7,8,8A,10,11,12,12B,13,14B-TETRADECAHYDROPICENE-4A-CARBOXYLIC ACID
  • 23-Hydroxy-3beta-{[beta-D-ribopyranosyl-(1->3)-6-deoxy-alpha-L-altropyranosyl-(1->2)-alpha-L-arabinopyranosyl]oxy}olean-12-en-28-oic acid