Sodium [7-Hydroxy-10,13-Dimethyl-17-(6-Methylheptan-2-Yl)-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-3-Yl] [(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methyl Hydrogen Phosphate
[CAS# 134917-45-6]

Identification

• Name: Sodium [7-Hydroxy-10,13-Dimethyl-17-(6-Methylheptan-2-Yl)-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[a]Phenanthren-3-Yl] [(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxopyrimidin-1-Yl)Oxolan-2-Yl]Methyl Hydrogen Phosphate
• Synonyms: Sodium [17-(1,5-Dimethylhexyl)-7-Hydroxy-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] [(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxo-Pyrimidin-1-Yl)Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate; Sodium [17-(1,5-Dimethylhexyl)-7-Hydroxy-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] [(2R,3S,5R)-3-Hydroxy-5-(5-Methyl-2,4-Dioxo-1-Pyrimidinyl)-2-Tetrahydrofuranyl]Methyl Hydrogen Phosphate; Sodium [(2R,3S,5R)-5-(2,4-Diketo-5-Methyl-Pyrimidin-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl [17-(1,5-Dimethylhexyl)-7-Hydroxy-10,13-Dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Yl] Hydrogen Phosphate
• Molecular Formula: C₃₇H₅₉N₂NaO₉P
• Molecular Weight: 729.84
• CAS Registry Number: 134917-45-6
• SMILES: [C@H]1(O[C@@H]([C@@H](O)C1)CO[P](OC3CC2=CC(O)C4C(C2(CC3)C)CCC5(C4CCC5C(CCCC(C)C)C)C)(=O)O)N6C(=O)NC(=O)C(=C6)C.[Na+]
• InChI: 1S/C37H59N2O9P.Na/c1-21(2)8-7-9-22(3)26-10-11-27-33-28(13-15-37(26,27)6)36(5)14-12-25(16-24(36)17-30(33)41)48-49(44,45)46-20-31-29(40)18-32(47-31)39-19-23(4)34(42)38-35(39)43;/h17,19,21-22,25-33,40-41H,7-16,18,20H2,1-6H3,(H,44,45)(H,38,42,43);/q;+1/t22?,25?,26?,27?,28?,29-,30?,31+,32+,33?,36?,37?;/m0./s1
• InChIKey: ABPUZECNOMNGJE-JPRARVLRSA-N