10,13-dimethyl-11,16,17-tris(oxidanyl)-17-(2-oxidanylethanoyl)-7,8,9,11,12,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one

Systemtic Name: 10,13-dimethyl-11,16,17-tris(oxidanyl)-17-(2-oxidanylethanoyl)-7,8,9,11,12,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one Openeye Name: 11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one CAS Name: 11,16,17-trihydroxy-17-(2-hydroxy-1-oxoethyl)-10,13-dimethyl-7,8,9,11,12,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one IUPAC Name: 11,16,17-trihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-7,8,9,11,12,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one Traditional Name: 17-glycoloyl-11,16,17-trihydroxy-10,13-dimethyl-7,8,9,11,12,16-hexahydro-6H-cyclopenta[a]phenanthren-3-one Formula: C21H26O6 MolecularWeight: 374.42754

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(C3C(C1=CC(C2(C(=O)CO)O)O)CCC4=CC(=O)C=CC34C)O

Isomeric SMILES

CC12CC(C3C(C1=CC(C2(C(=O)CO)O)O)CCC4=CC(=O)C=CC34C)O

InChI

InChI=1S/C21H26O6/c1-19-6-5-12(23)7-11(19)3-4-13-14-8-16(25)21(27,17(26)10-22)20(14,2)9-15(24)18(13)19/h5-8,13,15-16,18,22,24-25,27H,3-4,9-10H2,1-2H3