17-(2-adamantylcarbamoyl)-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid

Systemtic Name: 17-(2-adamantylcarbamoyl)-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid Openeye Name: 17-(2-adamantylcarbamoyl)-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid CAS Name: 17-[(2-adamantylamino)-oxomethyl]-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid IUPAC Name: 17-(2-adamantylcarbamoyl)-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid Traditional Name: 17-(2-adamantylcarbamoyl)-10,13-dimethyl-2,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene-3-carboxylic acid Formula: C31H43NO3 MolecularWeight: 477.67802

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2C(=O)NC4C5CC6CC(C5)CC4C6)CC=C7C3(CCC(=C7)C(=O)O)C

Isomeric SMILES

CC12CCC3C(C1CCC2C(=O)NC4C5CC6CC(C5)CC4C6)CC=C7C3(CCC(=C7)C(=O)O)C

InChI

InChI=1S/C31H43NO3/c1-30-9-7-19(29(34)35)16-22(30)3-4-23-24-5-6-26(31(24,2)10-8-25(23)30)28(33)32-27-20-12-17-11-18(14-20)15-21(27)13-17/h3,16-18,20-21,23-27H,4-15H2,1-2H3,(H,32,33)(H,34,35)