13-methyl-7-(5-oxidanylpentyl)-3-phenylmethoxy-7,8,9,11,12,14-hexahydro-6H-cyclopenta[a]phenanthren-17-one

Systemtic Name: 13-methyl-7-(5-oxidanylpentyl)-3-phenylmethoxy-7,8,9,11,12,14-hexahydro-6H-cyclopenta[a]phenanthren-17-one Openeye Name: 3-benzyloxy-7-(5-hydroxypentyl)-13-methyl-7,8,9,11,12,14-hexahydro-6H-cyclopenta[a]phenanthren-17-one CAS Name: 7-(5-hydroxypentyl)-13-methyl-3-phenylmethoxy-7,8,9,11,12,14-hexahydro-6H-cyclopenta[a]phenanthren-17-one IUPAC Name: 7-(5-hydroxypentyl)-13-methyl-3-phenylmethoxy-7,8,9,11,12,14-hexahydro-6H-cyclopenta[a]phenanthren-17-one Traditional Name: 3-benzoxy-7-(5-hydroxypentyl)-13-methyl-7,8,9,11,12,14-hexahydro-6H-cyclopenta[a]phenanthren-17-one Formula: C30H36O3 MolecularWeight: 444.60504

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1C=CC2=O)C(CC4=C3C=CC(=C4)OCC5=CC=CC=C5)CCCCCO

Isomeric SMILES

CC12CCC3C(C1C=CC2=O)C(CC4=C3C=CC(=C4)OCC5=CC=CC=C5)CCCCCO

InChI

InChI=1S/C30H36O3/c1-30-16-15-26-25-12-11-24(33-20-21-8-4-2-5-9-21)19-23(25)18-22(10-6-3-7-17-31)29(26)27(30)13-14-28(30)32/h2,4-5,8-9,11-14,19,22,26-27,29,31H,3,6-7,10,15-18,20H2,1H3