[(1S,4bR,7S,10aS)-7-[(1R)-1,2-bis(oxidanyl)ethyl]-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-1-yl]methyl ethanoate

Systemtic Name: [(1S,4bR,7S,10aS)-7-[(1R)-1,2-bis(oxidanyl)ethyl]-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-1-yl]methyl ethanoate Openeye Name: [(1S,4bR,7S,10aS)-7-[(1R)-1,2-dihydroxyethyl]-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-1-yl]methyl acetate CAS Name: acetic acid [(1S,4bR,7S,10aS)-7-[(1R)-1,2-dihydroxyethyl]-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-1-yl]methyl ester IUPAC Name: [(1S,4bR,7S,10aS)-7-[(1R)-1,2-dihydroxyethyl]-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-1-yl]methyl acetate Traditional Name: acetic acid [(1S,4bR,7S,10aS)-7-[(1R)-1,2-dihydroxyethyl]-1,4a,7-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthren-1-yl]methyl ester Formula: C22H36O4 MolecularWeight: 364.51884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(CCCC2(C1CCC3=CC(CCC32)(C)C(CO)O)C)C

Isomeric SMILES

CC(=O)OC[C@]1(CCCC2([C@@H]1CCC3=C[C@@](CC[C@H]32)(C)[C@H](CO)O)C)C

InChI

InChI=1S/C22H36O4/c1-15(24)26-14-21(3)9-5-10-22(4)17-8-11-20(2,19(25)13-23)12-16(17)6-7-18(21)22/h12,17-19,23,25H,5-11,13-14H2,1-4H3/t17-,18-,19+,20+,21-,22?/m1/s1