[(4S,5S,9R,14R,17R)-17-[(2S,3R,5S)-5-ethyl-3-hydroxy-6-methyl-heptan-2-yl]-4,10,13-trimethyl-6-oxo-1,2,3,4,5,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] benzoate
Molecular Formula:
C37H54O4
InChI: InChI=1/C37H54O4/c1-8-25(22(2)3)20-31(38)23(4)28-14-15-29-27-21-32(39)34-24(5)33(41-35(40)26-12-10-9-11-13-26)17-19-37(34,7)30(27)16-18-36(28,29)6/h9-13,21-25,28-31,33-34,38H,8,14-20H2,1-7H3/t23-,24+,25-,28+,29-,30-,31+,33?,34+,36u,37u/m0/s1
InChIKey: InChIKey=PQWWCRLPWBAFIP-NICLJBSJBA
SMILES: CCC(CC(C(C)C1CCC2C1(CCC3C2=CC(=O)C4C3(CCC(C4C)OC(=O)C5=CC=CC=C5)C)C)O)C(C)C
Names:
[(4S,5S,9R,14R,17R)-17-[(2S,3R,5S)-5-ethyl-3-hydroxy-6-methyl-heptan-2-yl]-4,10,13-trimethyl-6-oxo-1,2,3,4,5,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-yl] benzoate
Registries:
PubChem CID 6915721
PubChem ID 11564278
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