(3R,8R,9S,10R,13S,14S,17R)-17-(2-butylamino-1,3-thiazol-4-yl)-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol dihydrate

Molecular Formula: C26H44N2O4S


InChI: InChI=1/C26H40N2O2S.2H2O/c1-4-5-14-27-23-28-22(16-31-23)26(30)13-10-21-19-7-6-17-15-18(29)8-11-24(17,2)20(19)9-12-25(21,26)3;;/h15-16,18-21,29-30H,4-14H2,1-3H3,(H,27,28);2*1H2/t18-,19-,20+,21+,24+,25+,26+;;/m1../s1/f/h27H;;

InChIKey: InChIKey=FVXUQCYMOHEQAI-CFYPXYCLDC
SMILES: CCCCNC1=NC(=CS1)C2(CCC3C2(CCC4C3CCC5=CC(CCC45C)O)C)O.O.O

Names:
    ANDROST-4-ENE-3,17-alpha-DIOL, 17-(2-(BUTYLAMINO)-4-THIAZOLYL)-
    (3R,8R,9S,10R,13S,14S,17R)-17-(2-butylamino-1,3-thiazol-4-yl)-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-3,17-diol dihydrate
    101915-06-4
    17-beta-(2-(Butylamino)-4-thiazolyl)androst-4-ene-3-beta,17-alpha-diol dihydrate
    96113-08-5

Registries:
    PubChem CID 57019
    PubChem ID 194193