4a-ethyl-3,9,9-trimethyl-7-[(2-methylpyridin-3-yl)methoxy]-2-phenyl-1,4,10,10a-tetrahydrophenanthrene-2,3-diol

Systemtic Name: 4a-ethyl-3,9,9-trimethyl-7-[(2-methylpyridin-3-yl)methoxy]-2-phenyl-1,4,10,10a-tetrahydrophenanthrene-2,3-diol Openeye Name: 4a-ethyl-3,9,9-trimethyl-7-[(2-methyl-3-pyridyl)methoxy]-2-phenyl-1,4,10,10a-tetrahydrophenanthrene-2,3-diol CAS Name: 4a-ethyl-3,9,9-trimethyl-7-[(2-methyl-3-pyridinyl)methoxy]-2-phenyl-1,4,10,10a-tetrahydrophenanthrene-2,3-diol IUPAC Name: 4a-ethyl-3,9,9-trimethyl-7-[(2-methylpyridin-3-yl)methoxy]-2-phenyl-1,4,10,10a-tetrahydrophenanthrene-2,3-diol Traditional Name: 4a-ethyl-3,9,9-trimethyl-7-[(2-methyl-3-pyridyl)methoxy]-2-phenyl-1,4,10,10a-tetrahydrophenanthrene-2,3-diol Formula: C32H39NO3 MolecularWeight: 485.65696

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CC(C(CC1CC(C3=C2C=CC(=C3)OCC4=C(N=CC=C4)C)(C)C)(C5=CC=CC=C5)O)(C)O

Isomeric SMILES

CCC12CC(C(CC1CC(C3=C2C=CC(=C3)OCC4=C(N=CC=C4)C)(C)C)(C5=CC=CC=C5)O)(C)O

InChI

InChI=1S/C32H39NO3/c1-6-31-21-30(5,34)32(35,24-12-8-7-9-13-24)19-25(31)18-29(3,4)28-17-26(14-15-27(28)31)36-20-23-11-10-16-33-22(23)2/h7-17,25,34-35H,6,18-21H2,1-5H3