methyl (5R,8S,9R,10R,13R,14R)-10,13-dimethyl-17-methylidene-4-oxidanylidene-1,2,3,5,6,7,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-8-carboxylate

Systemtic Name: methyl (5R,8S,9R,10R,13R,14R)-10,13-dimethyl-17-methylidene-4-oxidanylidene-1,2,3,5,6,7,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-8-carboxylate Openeye Name: methyl (5R,8S,9R,10R,13R,14R)-10,13-dimethyl-17-methylene-4-oxo-1,2,3,5,6,7,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-8-carboxylate CAS Name: (5R,8S,9R,10R,13R,14R)-10,13-dimethyl-17-methylene-4-oxo-1,2,3,5,6,7,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-8-carboxylic acid methyl ester IUPAC Name: methyl (5R,8S,9R,10R,13R,14R)-10,13-dimethyl-17-methylidene-4-oxo-1,2,3,5,6,7,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-8-carboxylate Traditional Name: (5R,8S,9R,10R,13R,14R)-4-keto-10,13-dimethyl-17-methylene-1,2,3,5,6,7,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-8-carboxylic acid methyl ester Formula: C22H32O3 MolecularWeight: 344.48768

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCCC(=O)C1CCC3(C2CCC4(C3CCC4=C)C)C(=O)OC

Isomeric SMILES

C[C@]12CCCC(=O)[C@@H]1CC[C@@]3([C@@H]2CC[C@@]4([C@H]3CCC4=C)C)C(=O)OC

InChI

InChI=1S/C22H32O3/c1-14-7-8-17-20(14,2)12-10-18-21(3)11-5-6-16(23)15(21)9-13-22(17,18)19(24)25-4/h15,17-18H,1,5-13H2,2-4H3/t15-,17+,18+,20-,21-,22+/m0/s1