(13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl) hydrogen sulfate

Systemtic Name: (13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl) hydrogen sulfate Openeye Name: (13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl) hydrogen sulfate CAS Name: sulfuric acid (13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl) ester IUPAC Name: (13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl) hydrogen sulfate Traditional Name: sulfuric acid (13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-3-yl) ester Formula: C18H22O4S MolecularWeight: 334.42988

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CC=C2)CCC4=C3C=CC(=C4)OS(=O)(=O)O

Isomeric SMILES

CC12CCC3C(C1CC=C2)CCC4=C3C=CC(=C4)OS(=O)(=O)O

InChI

InChI=1S/C18H22O4S/c1-18-9-2-3-17(18)16-6-4-12-11-13(22-23(19,20)21)5-7-14(12)15(16)8-10-18/h2,5,7,9,11,15-17H,3-4,6,8,10H2,1H3,(H,19,20,21)