[2-[(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)carbamoyl]pyrrolidin-1-yl]-[[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]phosphinic acid; sodium

Systemtic Name: [2-[(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)carbamoyl]pyrrolidin-1-yl]-[[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy]phosphinic acid; sodium Openeye Name: [2-[(3-acetoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)carbamoyl]pyrrolidin-1-yl]-[[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]phosphinic acid; sodium CAS Name: [2-[[(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)amino]-oxomethyl]-1-pyrrolidinyl]-[[5-(2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methoxy]phosphinic acid; sodium IUPAC Name: [2-[(3-acetyloxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)carbamoyl]pyrrolidin-1-yl]-[[5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy]phosphinic acid; sodium Traditional Name: [2-[(3-acetoxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)carbamoyl]pyrrolidino]-[[5-(2,4-diketopyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]phosphinic acid; sodium Formula: C35H53N4NaO11P MolecularWeight: 759.779051

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3CCC4NC(=O)C5CCCN5P(=O)(O)OCC6C(C(C(O6)N7C=CC(=O)NC7=O)O)O)C)C.[Na]

Isomeric SMILES

CC(=O)OC1CCC2(C(C1)CCC3C2CCC4(C3CCC4NC(=O)C5CCCN5P(=O)(O)OCC6C(C(C(O6)N7C=CC(=O)NC7=O)O)O)C)C.[Na]

InChI

InChI=1S/C35H53N4O11P.Na/c1-19(40)49-21-10-13-34(2)20(17-21)6-7-22-23-8-9-27(35(23,3)14-11-24(22)34)36-31(44)25-5-4-15-39(25)51(46,47)48-18-26-29(42)30(43)32(50-26)38-16-12-28(41)37-33(38)45;/h12,16,20-27,29-30,32,42-43H,4-11,13-15,17-18H2,1-3H3,(H,36,44)(H,46,47)(H,37,41,45);