[5-(4-Amino-2-Oxopyrimidin-1-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methyl [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]-2-Oxoethyl] Hydrogen Phosphate
[CAS# 74517-55-8]

Identification

• Name: [5-(4-Amino-2-Oxopyrimidin-1-Yl)-3,4-Dihydroxyoxolan-2-Yl]Methyl [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[a]Phenanthren-17-Yl]-2-Oxoethyl] Hydrogen Phosphate
• Synonyms: [5-(4-Amino-2-Oxo-Pyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxo-Ethyl] Hydrogen Phosphate; [5-(4-Amino-2-Oxo-1-Pyrimidinyl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methyl [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-10,13-Dimethyl-3-Oxo-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Oxoethyl] Hydrogen Phosphate; [5-(4-Amino-2-Keto-Pyrimidin-1-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl [2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-Dihydroxy-3-Keto-10,13-Dimethyl-2,6,7,8,9,11,12,14,15,16-Decahydro-1H-Cyclopenta[A]Phenanthren-17-Yl]-2-Keto-Ethyl] Hydrogen Phosphate
• Molecular Formula: C₃₀H₄₂N₃O₁₂P
• Molecular Weight: 667.65
• CAS Registry Number: 74517-55-8
• SMILES: [C@@H]1(O)[C@H]5[C@H]([C@H]4[C@](C)(C1)[C@@](O)(C(=O)CO[P](OCC3OC(N2C(=O)N=C(C=C2)N)C(C3O)O)(O)=O)CC4)CCC6=CC(CC[C@]56C)=O
• InChI: 1S/C30H42N3O12P/c1-28-8-5-16(34)11-15(28)3-4-17-18-6-9-30(40,29(18,2)12-19(35)23(17)28)21(36)14-44-46(41,42)43-13-20-24(37)25(38)26(45-20)33-10-7-22(31)32-27(33)39/h7,10-11,17-20,23-26,35,37-38,40H,3-6,8-9,12-14H2,1-2H3,(H,41,42)(H2,31,32,39)/t17-,18-,19-,20?,23+,24?,25?,26?,28-,29-,30-/m0/s1
• InChIKey: PYRHNBFJHWMQSW-NTXUZSMHSA-N

Properties

• Density: 1.733g/cm³ (Cal.)
• Boiling point: 891.429°C at 760 mmHg (Cal.)
• Flash point: 492.919°C (Cal.)