5-Amino-1-(5-O-phosphonopentofuranosyl)-1H-imidazole-4-carboxamide

HCID 200CAS 3031-94-5

Basic information

Standard SMILES
NC(=O)c1ncn(C2OC(COP(=O)(O)O)C(O)C2O)c1N
InChIKey
NOTGFIUVDGNKRI-UHFFFAOYSA-N
Molecular formula
C9H15N4O8P
Average molar mass
338.21 g/mol
Monoisotopic mass
338.06275007

Overview

[5-(5-amino-4-carbamoyl-1-imidazolyl)-3,4-dihydroxy-2-oxolanyl]methyl dihydrogen phosphate is a 1-ribosylimidazolecarboxamide.

Names & identifiers

Preferred name
5-Amino-1-(5-O-phosphonopentofuranosyl)-1H-imidazole-4-carboxamide
IUPAC
[5-(5-amino-4-carbamoylimidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

Names & synonyms

DTXSID508630815-Amino-1-(5-O-phosphonopentofuranosyl)-1H-imidazole-4-carboxamideRefChem:1072609DTXCID60811755ButylammoniumLeadIodide132069-10-4AICA-Riboside, 5'-Phosphate1H-imidazole-4-carboxamide, 5-amino-1-(5-O-phosphono-beta-D-ribofuranosyl)-Imidazole-4-carboxamide, 5'-(dihydrogen phosphate)NSC283955NSC2922271H-Imidazole-4-carboxamide, 5-amino-1-(5-O-phosphono-.beta.-D-ribofuranosyl)-
Show more names
di-n-butylammonium lead(II) tetraIodideButylammonium Lead Iodide[5-(5-amino-4-carbamoylimidazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphateCHEMBL274436SCHEMBL1230589CHEBI:93885BDBM526262ZMP

Database identifiers

CAS
3031-94-5
PubChem CID
200
DTXSID
DTXSID50863081
ChEMBL
CHEMBL274436
ChEBI
CHEBI:93885

Properties

Computed structural properties

XLogP
-3.8
Topological polar surface area
203 Ų
Hydrogen bond donors
6
Hydrogen bond acceptors
10
Rotatable bonds
5
Heavy atoms
22

Related reactions

0 records

No reaction records under the current filter.

Linked notes

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