Aica ribonucleotide

C9H15N4O8PCAS 3031-94-5338.21 g/mol

H2NONNOOPOOHOHOHHOH2N
AlcoholEtherPhosphatePrimary amine

Properties

Molecular formula
C9H15N4O8P
Molar mass
338.21 g/mol
Exact mass
338.0628 Da
Melting point
198–202 °C (decomposes)
logP
-1.92Crippen estimate
Polar surface area
204.4 Ų
H-bond donors / acceptors
7 / 8
Rotatable bonds
5
Stereocentres
R, R, S, Rin SMILES atom order

Identifiers

CAS number
3031-94-5
SMILES
N=C(O)c1ncn([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)c1N
InChIKey
NOTGFIUVDGNKRI-UUOKFMHZSA-N
InChI
InChI=1S/C9H15N4O8P/c10-7-4(8(11)16)12-2-13(7)9-6(15)5(14)3(21-9)1-20-22(17,18)19/h2-3,5-6,9,14-15H,1,10H2,(H2,11,16)(H2,17,18,19)/t3-,5-,6-,9-/m1/s1

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Names and synonyms

25 names · show all
  • 1H-Imidazole-4-carboxamide, 5-amino-1-(5-O-phosphono-β-D-ribofuranosyl)-
  • Imidazole-4-carboxamide, 5-amino-1-β-D-ribofuranosyl-, 5′-(dihydrogen phosphate)
  • Imidazole-4-carboxamide, 5-amino-1-β-D-ribofuranosyl-, 5′-phosphate
  • 5-Amino-1-(5-O-phosphono-β-D-ribofuranosyl)-1H-imidazole-4-carboxamide
  • AICAR
  • 5-Amino-1-(5′-phosphofuranoribosyl)-4-imidazolecarboxamide
  • 5-Amino-1β-D-ribofuranosylimidazole-4-carboxamide 5′-phosphate
  • 5′-Phospho-β-D-ribosyl-5-amino-4-imidazolecarboxamide
  • 5-Amino-4-imidazolecarboxamide ribotide
  • 5-Amino-4-imidazolecarboxamide ribonucleoside 5′-monophosphate
  • 5′-Phosphoribosyl-5-amino-4-imidazolecarboxamide
  • 5-Amino-4-imidazolecarboxamide ribonucleotide
  • ZMP
  • Aminoimidazolecarboxamide ribonucleotide
  • AICA-Ribonucleotide
  • AICA Ribotide
  • 5-Amino-4-imidazolecarboxamide riboside 5′-monophosphate
  • Acadesine 5′-monophosphate
  • NSC 283955
  • NSC 292227
  • (2R,3 S,4R,5R)-5-(4-Carbam0yl-5-aminoimidazol-1-yl)-3,4-dihydroxyoxolan-2-yljmethyl dihydrogen phosphate
  • 5-Aminoimidazole-4-carboxamide ribonucleotide
  • 5-Aminoimidazole-4-carboxamide-1-beta-D-ribofuranosyl 5′-monophosphate
  • AICAR (5-Aminoimidazole-4-carboxamide-1-β-D-ribofuranosyl 5′-monophosphate)
  • ZMP (alarmone)

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Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

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