Digitoxigenin-3-beta-(3-methyl-D-alanyl) ester
Molecular Formula:
C27H41NO5
InChI: InChI=1/C27H41NO5/c1-4-22(28)24(30)33-18-7-10-25(2)17(14-18)5-6-21-20(25)8-11-26(3)19(9-12-27(21,26)31)16-13-23(29)32-15-16/h13,17-22,31H,4-12,14-15,28H2,1-3H3/t17-,18+,19-,20+,21-,22?,25+,26-,27-/m1/s1
InChIKey: InChIKey=FGDUPFDTXRVJPO-SYHJTCBSBJ
SMILES: CCC(C(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3(CCC4C5=CC(=O)OC5)O)C)C)N
Names:
Digitoxigenin-3-beta-(3-methyl-D-alanyl) ester
3-beta,14-Dihydroxy-5-beta-card-20(22)-enolide 3-ester with D-2-aminobutyric acid
5-beta-Card-20(22)-enolide, 3-beta,14-dihydroxy-, 3-(2-aminobutyrate) (ester), D-
5-beta-CARD-20(22)-ENOLIDE, 3-beta,14-DIHYDROXY-, 3-(2-AMINOBUTYRATE) (ester), D
81072-19-7
[(3S,5R,8R,9S,10S,13R,14R,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] 2-aminobutanoate
Registries:
PubChem CID 3033684
PubChem ID 192209
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