Chemical Compound

(13alpha,14beta,17alpha)-3,15-Dioxo-4a-methyl-4abeta-(hydroxymethyl)-12alpha-(isovaleryloxy)-14-hydroxy-1alpha,11beta:21,23-diepoxy-A-homo-24-nor-4-oxa-6,7-seco-5alpha-chola-7,20,22-triene-6-carboxylic acid delta-lactone

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(13alpha,14beta,17alpha)-3,15-Dioxo-4a-methyl-4abeta-(hydroxymethyl)-12alpha-(isovaleryloxy)-14-hydroxy-1alpha,11beta:21,23-diepoxy-A-homo-24-nor-4-oxa-6,7-seco-5alpha-chola-7,20,22-triene-6-carboxylic acid delta-lactone 结构式
Primary record

(13alpha,14beta,17alpha)-3,15-Dioxo-4a-methyl-4abeta-(hydroxymethyl)-12alpha-(isovaleryloxy)-14-hydroxy-1alpha,11beta:21,23-diepoxy-A-homo-24-nor-4-oxa-6,7-seco-5alpha-chola-7,20,22-triene-6-carboxylic acid delta-lactone

库存
550 克
纯度
98.1 %

化合物标识与属性

PubChem CID
100938103
SMILES
CC(C)CC(=O)O[C@H]1[C@H]2[C@@H](C(=C)[C@@]3([C@@]1([C@@H](CC3=O)C4=COC=C4)C)O)[C@@]5([C@H]6CC(=O)OC[C@]6(OC(=O)C[C@@H]5O2)C)C
Canonical SMILES
C=C1[C@@H]2[C@@H](O[C@H]3CC(=O)O[C@]4(C)COC(=O)C[C@@H]4[C@]32C)[C@H](OC(=O)CC(C)C)[C@@]2(C)[C@H](c3ccoc3)CC(=O)[C@]12O

名称与同义词

  • Rohituka 14
  • J1.159.947H
  • (13alpha,14beta,17alpha)-3,15-Dioxo-4a-methyl-4abeta-(hydroxymethyl)-12alpha-(isovaleryloxy)-14-hydroxy-1alpha,11beta:21,23-diepoxy-A-homo-24-nor-4-oxa-6,7-seco-5alpha-chola-7,20,22-triene-6-carboxylic acid delta-lactone
  • (1R,2R,4S,7S,8R,9R,10R,12S,16S,21R)-7-(furan-3-yl)-4-hydroxy-1,8,16-trimethyl-3-methylidene-5,14,19-trioxo-11,15,18-trioxapentacyclo[10.9.0.02,10.04,8.016,21]henicosan-9-yl 3-methylbutanoate