[3-(carboxyoxymethyl)-10,13-dimethyl-7-oxidanylidene-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]methyl hydrogen carbonate

Systemtic Name: [3-(carboxyoxymethyl)-10,13-dimethyl-7-oxidanylidene-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]methyl hydrogen carbonate Openeye Name: [3-(carboxyoxymethyl)-10,13-dimethyl-7-oxo-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]methyl hydrogen carbonate CAS Name: carbonic acid [3-(carboxyoxymethyl)-10,13-dimethyl-7-oxo-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]methyl ester IUPAC Name: [3-(carboxyoxymethyl)-10,13-dimethyl-7-oxo-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]methyl hydrogen carbonate Traditional Name: carbonic acid [3-(carboxyoxymethyl)-7-keto-10,13-dimethyl-1,2,3,4,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]methyl ester Formula: C23H32O7 MolecularWeight: 420.49598

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2COC(=O)O)C(=O)C=C4C3(CCC(C4)COC(=O)O)C

Isomeric SMILES

CC12CCC3C(C1CCC2COC(=O)O)C(=O)C=C4C3(CCC(C4)COC(=O)O)C

InChI

InChI=1S/C23H32O7/c1-22-8-6-17-19(16(22)4-3-14(22)12-30-21(27)28)18(24)10-15-9-13(11-29-20(25)26)5-7-23(15,17)2/h10,13-14,16-17,19H,3-9,11-12H2,1-2H3,(H,25,26)(H,27,28)