13-hexadecyl-3-methoxy-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one

Systemtic Name: 13-hexadecyl-3-methoxy-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one Openeye Name: 13-hexadecyl-3-methoxy-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one CAS Name: 13-hexadecyl-3-methoxy-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one IUPAC Name: 13-hexadecyl-3-methoxy-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one Traditional Name: 13-cetyl-3-methoxy-7,11,12,14,15,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one Formula: C34H52O2 MolecularWeight: 492.77548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC12CCC3=C(C1CCC2=O)CCC4=C3C=CC(=C4)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCC12CCC3=C(C1CCC2=O)CCC4=C3C=CC(=C4)OC

InChI

InChI=1S/C34H52O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-24-34-25-23-30-29-20-18-28(36-2)26-27(29)17-19-31(30)32(34)21-22-33(34)35/h18,20,26,32H,3-17,19,21-25H2,1-2H3