[(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-morpholino-phosphinic acid; N,N'-dicyclohexylmorpholine-4-carboxamidine
[CAS# 7361-07-1]

Identification

• Name: [(2R,3S,4R,5R)-5-(2-amino-6-oxo-3H-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-morpholino-phosphinic acid; N,N'-dicyclohexylmorpholine-4-carboxamidine
• Synonyms: GUANOSINE5'-MONOPHOSPHOMORPHOLIDATE4-MORPHOLINE-N,N'-DICYCLOHEXYLCARBOXAMIDINESALT
• Molecular Formula: C₃₁H₅₂N₉O₉P
• Molecular Weight: 725.77
• CAS Registry Number: 7361-07-1
• SMILES: O=C4/N=C(/N)Nc1c4ncn1[C@@H]2O[C@@H]([C@@H](O)[C@H]2O)COP(=O)(O)N3CCOCC3.N(=C(/NC1CCCCC1)N2CCOCC2)\C3CCCCC3
• InChI: 1S/C17H31N3O.C14H21N6O8P/c1-3-7-15(8-4-1)18-17(20-11-13-21-14-12-20)19-16-9-5-2-6-10-16;15-14-17-11-8(12(23)18-14)16-6-20(11)13-10(22)9(21)7(28-13)5-27-29(24,25)19-1-3-26-4-2-19/h15-16H,1-14H2,(H,18,19);6-7,9-10,13,21-22H,1-5H2,(H,24,25)(H3,15,17,18,23)/t;7-,9-,10-,13-/m.1/s1
• InChIKey: CFNWUGDJWKRMBL-VAMAKUSHSA-N

Properties

• Boiling point: 844.2°C at 760 mmHg (Cal.)
• Flash point: 464.4°C (Cal.)