17-[(E)-5,6-dimethyl-5,6-bis(oxidanyl)hept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol

Systemtic Name: 17-[(E)-5,6-dimethyl-5,6-bis(oxidanyl)hept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol Openeye Name: 17-[(E)-4,5-dihydroxy-1,4,5-trimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol CAS Name: 17-[(E)-5,6-dihydroxy-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol IUPAC Name: 17-[(E)-5,6-dihydroxy-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol Traditional Name: 17-[(E)-4,5-dihydroxy-1,4,5-trimethyl-hex-2-enyl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-1,3-diol Formula: C28H44O4 MolecularWeight: 444.64656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H44O4/c1-17(11-14-27(5,32)25(2,3)31)21-9-10-22-20-8-7-18-15-19(29)16-24(30)28(18,6)23(20)12-13-26(21,22)4/h7-8,11,14,17,19,21-24,29-32H,9-10,12-13,15-16H2,1-6H3/b14-11+