Monobutyryl Cyclic Gmp
[CAS# 52246-50-1]

Identification

• Name: Monobutyryl Cyclic Gmp
• Synonyms: [(2R,3S,4R,5R)-5-[2-[[(E)-But-2-Enoyl]Amino]Purin-9-Yl]-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate; [(2R,3S,4R,5R)-3,4-Dihydroxy-5-[2-[[(E)-1-Oxobut-2-Enyl]Amino]-9-Purinyl]-2-Tetrahydrofuranyl]Methyl Dihydrogen Phosphate; [(2R,3S,4R,5R)-5-[2-[[(E)-But-2-Enoyl]Amino]Purin-9-Yl]-3,4-Dihydroxy-Oxolan-2-Yl]Methyl Dihydrogen Phosphate
• Molecular Formula: C₁₄H₁₈N₅O₈P
• Molecular Weight: 415.30
• CAS Registry Number: 52246-50-1
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H]1O)CO[P](=O)(O)O)[N]2C3=C(N=C2)C=NC(=N3)NC(=O)\C=C\C
• InChI: 1S/C14H18N5O8P/c1-2-3-9(20)17-14-15-4-7-12(18-14)19(6-16-7)13-11(22)10(21)8(27-13)5-26-28(23,24)25/h2-4,6,8,10-11,13,21-22H,5H2,1H3,(H2,23,24,25)(H,15,17,18,20)/b3-2+/t8-,10-,11-,13-/m1/s1
• InChIKey: WLJLTNJBLUCOLV-RGBORCEKSA-N

Properties

• Density: 1.903g/cm³ (Cal.)