[(2R,3R,6R)-6-[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2,3-dimethyl-heptyl] (2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate

Molecular Formula: C44H65F3O9


InChI: InChI=1/C44H65F3O9/c1-25(27(3)24-54-40(52)43(53-6,44(45,46)47)28-10-8-7-9-11-28)12-13-26(2)32-16-17-33-31-15-14-29-22-30(18-20-41(29,4)34(31)19-21-42(32,33)5)55-39-38(51)37(50)36(49)35(23-48)56-39/h7-11,14,25-27,30-39,48-51H,12-13,15-24H2,1-6H3/t25-,26-,27-,30+,31+,32-,33+,34+,35-,36-,37+,38-,39-,41+,42-,43-/m1/s1

InChIKey: InChIKey=IWNOPRKULXPABX-ZAHMNTNYBL
SMILES: CC(CCC(C)C(C)COC(=O)C(C1=CC=CC=C1)(C(F)(F)F)OC)C2CCC3C2(CCC4C3CC=C5C4(CCC(C5)OC6C(C(C(C(O6)CO)O)O)O)C)C

Names:
    [(2R,3R,6R)-6-[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2,3-dimethyl-heptyl] (2R)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate

Registries:
    PubChem CID 11170271
    PubChem ID 16249745