Chemical Compound

5-[(3-carboxy-5-chloro-4-hydroxy-phenyl)-[(5S,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ylidene]methyl]-3-chloro-2-hydroxy-benzoic acid

5-[(3-carboxy-5-chloro-4-hydroxy-phenyl)-[(5S,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ylidene]methyl]-3-chloro-2-hydroxy-benzoic acid 结构式
Primary record

5-[(3-carboxy-5-chloro-4-hydroxy-phenyl)-[(5S,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ylidene]methyl]-3-chloro-2-hydroxy-benzoic acid

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
460278
SMILES
C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@@H]4[C@@]3(CCC(=C(C5=CC(=C(C(=C5)Cl)O)C(=O)O)C6=CC(=C(C(=C6)Cl)O)C(=O)O)C4)C)C
Canonical SMILES
CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=C(c5cc(Cl)c(O)c(C(=O)O)c5)c5cc(Cl)c(O)c(C(=O)O)c5)CC[C@]4(C)[C@H]3CC[C@]12C

名称与同义词

  • Cosalane analog
  • AC1LA239
  • AIDS025249
  • CID460278
  • J658.112I
  • 5.alpha.-3-[Bis(3'-carboxy-5'-chloro-4'-hydroxyphenyl)methylene]cholestane
  • 3,3 -[(5alpha-Cholestan-3-ylidene)methylene]bis(5-chloro-6-hydroxybenzoic acid)
  • 5-[(3-carboxy-5-chloro-4-hydroxy-phenyl)-[(5S,8R,9S,10S,13R,14S,17R)-17-[(1R)-1,5-dimethylhexyl]-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ylidene]methyl]-3-chloro-2-hydroxy-benzoic acid
  • 5-[(3-carboxy-5-chloro-4-hydroxyphenyl)-[(5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ylidene]methyl]-3-chloro-2-hydroxybenzoic acid
  • 5-{[(1R,3aS,3bR,5aS,9aS,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-hexadecahydro-1H-cyclopenta[a]phenanthren-7-ylidene](3-carboxy-5-chloro-4-hydroxyphenyl)methyl}-3-chloro-2-hydroxybenzoic acid