Digitoxigenin acetate
Molecular Formula:
C25H36O5
InChI: InChI=1/C25H36O5/c1-15(26)30-18-6-9-23(2)17(13-18)4-5-21-20(23)7-10-24(3)19(8-11-25(21,24)28)16-12-22(27)29-14-16/h12,17-21,28H,4-11,13-14H2,1-3H3/t17-,18+,19-,20u,21u,23+,24-,25+/m1/s1
InChIKey: InChIKey=WJOGTCZNZPHODB-ARMHMIHABE
SMILES: CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3(CCC4C5=CC(=O)OC5)O)C)C
Names:
BRN 0097888
Card-20(22)-enolide, 3-(acetyloxy)-14-hydroxy-, (3-beta,5-beta)-
Digitoxigenin acetate
Digitoxigenin-3-acetate
EINECS 212-363-4
3-Acetyldigitoxigenin
3-beta-Acetoxy-14-hydroxy-5-beta,14-beta-card-20(22)-enolide
3-O-Acetyldigitoxigenin
4-18-00-01472 (Beilstein Handbook Reference)
5-beta-CARD-20(22)-ENOLIDE, 3-beta,14-DIHYDROXY-, 3-ACETATE
[(3S,5R,10S,13R,14S,17S)-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
Registries:
PubChem CID 13125
PubChem ID 156478
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