4-Amino-1-(5-O-Palmitoylpentofuranosyl)-2(1H)-Pyrimidinone
[CAS# 31088-06-9]

Identification

• Name: 4-Amino-1-(5-O-Palmitoylpentofuranosyl)-2(1H)-Pyrimidinone
• Synonyms: Arabinosyl cytosine palmitate; Aracytidine 5'-palmitate; Hexadec-9-enoic acid 5-(4-amino-2-oxo-2H-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydro-furan-2-ylmethyl ester
• Molecular Formula: C₂₅H₄₃N₃O₆
• Molecular Weight: 481.63
• CAS Registry Number: 31088-06-9
• SMILES: CCCCCCCCCCCCCCCC(=O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O
• InChI: 1S/C25H43N3O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(29)33-18-19-22(30)23(31)24(34-19)28-17-16-20(26)27-25(28)32/h16-17,19,22-24,30-31H,2-15,18H2,1H3,(H2,26,27,32)
• InChIKey: SHBAKEKBTCPUFI-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 634.1±65.0°C at 760 mmHg (Cal.)
• Flash point: 337.3±34.3°C (Cal.)