2-[10,13-dimethyl-16-methylidene-11,17-bis(oxidanyl)-3-oxidanylidene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethanal

Systemtic Name: 2-[10,13-dimethyl-16-methylidene-11,17-bis(oxidanyl)-3-oxidanylidene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxidanylidene-ethanal Openeye Name: 2-(11,17-dihydroxy-10,13-dimethyl-16-methylene-3-oxo-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde CAS Name: 2-(11,17-dihydroxy-10,13-dimethyl-16-methylene-3-oxo-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoacetaldehyde IUPAC Name: 2-(11,17-dihydroxy-10,13-dimethyl-16-methylidene-3-oxo-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoacetaldehyde Traditional Name: 2-(11,17-dihydroxy-3-keto-10,13-dimethyl-16-methylene-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl)-2-keto-acetaldehyde Formula: C22H26O5 MolecularWeight: 370.43884

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(C3C(C1CC(=C)C2(C(=O)C=O)O)CCC4=CC(=O)C=CC34C)O

Isomeric SMILES

CC12CC(C3C(C1CC(=C)C2(C(=O)C=O)O)CCC4=CC(=O)C=CC34C)O

InChI

InChI=1S/C22H26O5/c1-12-8-16-15-5-4-13-9-14(24)6-7-20(13,2)19(15)17(25)10-21(16,3)22(12,27)18(26)11-23/h6-7,9,11,15-17,19,25,27H,1,4-5,8,10H2,2-3H3