(1S,3R,9S,10R,13R,14R,17R)-1,10,13-trimethyl-17-[(2S)-1-oxidanylpropan-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,3-diol

Systemtic Name: (1S,3R,9S,10R,13R,14R,17R)-1,10,13-trimethyl-17-[(2S)-1-oxidanylpropan-2-yl]-2,3,4,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,3-diol Openeye Name: (1S,3R,9S,10R,13R,14R,17R)-17-[(1S)-2-hydroxy-1-methyl-ethyl]-1,10,13-trimethyl-2,3,4,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,3-diol CAS Name: (1S,3R,9S,10R,13R,14R,17R)-17-[(2S)-1-hydroxypropan-2-yl]-1,10,13-trimethyl-2,3,4,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,3-diol IUPAC Name: (1S,3R,9S,10R,13R,14R,17R)-17-[(2S)-1-hydroxypropan-2-yl]-1,10,13-trimethyl-2,3,4,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,3-diol Traditional Name: (1S,3R,9S,10R,13R,14R,17R)-17-[(1S)-2-hydroxy-1-methyl-ethyl]-1,10,13-trimethyl-2,3,4,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-1,3-diol Formula: C23H36O3 MolecularWeight: 360.53014

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C1CCC2C1(CCC3C2=CC=C4C3(C(CC(C4)O)(C)O)C)C

Isomeric SMILES

C[C@H](CO)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3([C@@](C[C@@H](C4)O)(C)O)C)C

InChI

InChI=1S/C23H36O3/c1-14(13-24)18-7-8-19-17-6-5-15-11-16(25)12-22(3,26)23(15,4)20(17)9-10-21(18,19)2/h5-6,14,16,18-20,24-26H,7-13H2,1-4H3/t14-,16-,18-,19+,20+,21-,22+,23+/m1/s1