(4aS,10aS)-4a-(hydroxymethyl)-6-methoxy-1,1-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one

Systemtic Name: (4aS,10aS)-4a-(hydroxymethyl)-6-methoxy-1,1-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one Openeye Name: (4aS,10aS)-4a-(hydroxymethyl)-6-methoxy-1,1-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one CAS Name: (4aS,10aS)-4a-(hydroxymethyl)-6-methoxy-1,1-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one IUPAC Name: (4aS,10aS)-4a-(hydroxymethyl)-6-methoxy-1,1-dimethyl-3,4,10,10a-tetrahydro-2H-phenanthren-9-one Traditional Name: (4aS,10aS)-6-methoxy-1,1-dimethyl-4a-methylol-3,4,10,10a-tetrahydro-2H-phenanthren-9-one Formula: C18H24O3 MolecularWeight: 288.38136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC2(C1CC(=O)C3=C2C=C(C=C3)OC)CO)C

Isomeric SMILES

CC1(CCC[C@@]2([C@H]1CC(=O)C3=C2C=C(C=C3)OC)CO)C

InChI

InChI=1S/C18H24O3/c1-17(2)7-4-8-18(11-19)14-9-12(21-3)5-6-13(14)15(20)10-16(17)18/h5-6,9,16,19H,4,7-8,10-11H2,1-3H3/t16-,18+/m0/s1