1-[10,13-dimethyl-11,17-bis(oxidanyl)-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanyl-ethanone

Systemtic Name: 1-[10,13-dimethyl-11,17-bis(oxidanyl)-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanyl-ethanone Openeye Name: 1-(11,17-dihydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-hydroxy-ethanone CAS Name: 1-(11,17-dihydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-hydroxyethanone IUPAC Name: 1-(11,17-dihydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-hydroxyethanone Traditional Name: 1-(11,17-dihydroxy-10,13-dimethyl-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-hydroxy-ethanone Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC=C1CCC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O

Isomeric SMILES

CC12CCCC=C1CCC3C2C(CC4(C3CCC4(C(=O)CO)O)C)O

InChI

InChI=1S/C21H32O4/c1-19-9-4-3-5-13(19)6-7-14-15-8-10-21(25,17(24)12-22)20(15,2)11-16(23)18(14)19/h5,14-16,18,22-23,25H,3-4,6-12H2,1-2H3