Chemical Compound

(4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-11-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid

(4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-11-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid 结构式
Primary record

(4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-11-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
16105266
SMILES
C[C@@]12CC[C@@H]3[C@@]([C@H]1CC=C4[C@]2(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)(C[C@H]([C@@H](C3(C)C)O)OC(=O)/C=C/C6=CC(=C(C=C6)O)O)C
Canonical SMILES
CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](OC(=O)/C=C/c6ccc(O)c(O)c6)[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1

名称与同义词

  • 2-O-caffeoyl maslinic acid
  • 2-O-Caffeoyl maslinate
  • RefChem:88806
  • CHEBI:65547
  • CHEMBL4126277
  • J2.402.815A
  • Q27134000
  • (2alpha,3beta)-2-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-3-hydroxyolean-12-en-28-oic acid
  • (4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-11-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
  • 2alpha-[3-(3,4-Dihydroxyphenyl)acryloyloxy]-3beta-hydroxy-5alpha-oleana-12-ene-28-oic acid
  • (2alpha,3beta)-2-(((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl)oxy)-3-hydroxyolean-12-en-28-oic acid
  • (4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-11-((E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl)oxy-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
  • (4aS,6aS,6bR,8aR,10R,11R,12aR,12bR,14bS)-11-{[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid