24-Norchola-20,22-diene-4-carboxaldehyde, 3,12-bis(acetyloxy)-14,15:21,23-diepoxy-1,7,19-trihydroxy-4,8-dimethyl-11-oxo-, cyclic 4,19-(acetyl acetal), [1.alpha.,3.alpha.,4.beta.(S),5.alpha.,7.alpha.,12.alpha.,13.alpha.,14.beta.,15.beta.,17.alpha.]-

化合物标识与属性

CAS

62078-28-8

PubChem CID

73497

SMILES

CC(=O)O[C@@H]1C[C@@H]([C@@]23CO[C@H]([C@]1([C@@H]2C[C@H]([C@@]4([C@@H]3C(=O)[C@@H]([C@@]5([C@]46[C@H](O6)C[C@H]5C7=COC=C7)C)OC(=O)C)C)O)C)OC(=O)C)O

Canonical SMILES

CC(=O)O[C@@H]1OC[C@@]23[C@H]4C(=O)[C@H](OC(C)=O)[C@@]5(C)[C@H](c6ccoc6)C[C@H]6O[C@]65[C@]4(C)[C@H](O)C[C@H]2[C@@]1(C)[C@H](OC(C)=O)C[C@@H]3O