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(3S,7R,10R,13R)-10,13-dimethyl-17-octyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

(3S,7R,10R,13R)-10,13-dimethyl-17-octyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol

Systemtic Name:(3S,7R,10R,13R)-10,13-dimethyl-17-octyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Openeye Name:(3S,7R,10R,13R)-10,13-dimethyl-17-octyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
CAS Name:(3S,7R,10R,13R)-10,13-dimethyl-17-octyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
IUPAC Name:(3S,7R,10R,13R)-10,13-dimethyl-17-octyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Traditional Name:(3S,7R,10R,13R)-10,13-dimethyl-17-octyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,7-diol
Formula: C27H46O2
MolecularWeight: 402.65294
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC2C1(CCC3C2C(C=C4C3(CCC(C4)O)C)O)C


Isomeric SMILES

CCCCCCCCC1CCC2[C@@]1(CCC3C2[C@H](C=C4[C@@]3(CC[C@@H](C4)O)C)O)C


InChI

InChI=1S/C27H46O2/c1-4-5-6-7-8-9-10-19-11-12-22-25-23(14-16-26(19,22)2)27(3)15-13-21(28)17-20(27)18-24(25)29/h18-19,21-25,28-29H,4-17H2,1-3H3/t19?,21-,22?,23?,24-,25?,26+,27-/m0/s1


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