3-ACETYLDIGOXIGENIN

3-ACETYLDIGOXIGENIN

Name: 3-ACETYLDIGOXIGENIN

CAS: 80680-86-0

Formula: C25 H36 O6

Weight: 432.553

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Name: 3-ACETYLDIGOXIGENIN
CAS: 80680-86-0
Synonyms: 3-ACETYLDIGOXIGENIN
MDL.: MFCD01740256
H bond acceptor: 6
H bond donor: 2
Smile: CC(=O)O[C@H]1CC[C@]2([C@@H](C1)CC[C@@H]3[C@@H]2C[C@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O)C
InChi: InChI=1S/C25H36O6/c1-14(26)31-17-6-8-23(2)16(11-17)4-5-19-20(23)12-21(27)24(3)18(7-9-25(19,24)29)15-10-22(28)30-13-15/h10,16-21,27,29H,4-9,11-13H2,1-3H3/t16-,17+,18-,19-,20+,21-,23+,24+,25+/m1/s1
InChiKey: InChIKey=BRPTXGUNXVNFHJ-KCYBFLPASA-N