(5S,8R,9R,10S,14R)-4,4-diethyl-5,14-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,6,7,8,9,10,11,12,15,16-dodecahydrocyclopenta[a]phenanthrene

Systemtic Name: (5S,8R,9R,10S,14R)-4,4-diethyl-5,14-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,6,7,8,9,10,11,12,15,16-dodecahydrocyclopenta[a]phenanthrene Openeye Name: (5S,8R,9R,10S,14R)-17-[(1R)-1,5-dimethylhexyl]-4,4-diethyl-5,14-dimethyl-1,2,3,6,7,8,9,10,11,12,15,16-dodecahydrocyclopenta[a]phenanthrene CAS Name: (5S,8R,9R,10S,14R)-4,4-diethyl-5,14-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,6,7,8,9,10,11,12,15,16-dodecahydrocyclopenta[a]phenanthrene IUPAC Name: (5S,8R,9R,10S,14R)-4,4-diethyl-5,14-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,3,6,7,8,9,10,11,12,15,16-dodecahydrocyclopenta[a]phenanthrene Traditional Name: (5S,8R,9R,10S,14R)-17-[(1R)-1,5-dimethylhexyl]-4,4-diethyl-5,14-dimethyl-1,2,3,6,7,8,9,10,11,12,15,16-dodecahydrocyclopenta[a]phenanthrene Formula: C31H54 MolecularWeight: 426.76046

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCC2C1(CCC3C2CCC4=C(CCC34C)C(C)CCCC(C)C)C)CC

Isomeric SMILES

CCC1(CCC[C@@H]2[C@@]1(CC[C@@H]3[C@@H]2CCC4=C(CC[C@]34C)[C@H](C)CCCC(C)C)C)CC

InChI

InChI=1S/C31H54/c1-8-31(9-2)19-11-14-28-25-15-16-26-24(23(5)13-10-12-22(3)4)17-20-29(26,6)27(25)18-21-30(28,31)7/h22-23,25,27-28H,8-21H2,1-7H3/t23-,25+,27-,28+,29+,30+/m1/s1