EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:45140 - 2-amino-5-(aminomethyl)-7-(5-O-phosphono-β-D-ribofuranosyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one

ChEBI IDCHEBI:45140
ChEBI Name2-amino-5-(aminomethyl)-7-(5-O-phosphono-β-D-ribofuranosyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
Stars
ASCII Name2-amino-5-(aminomethyl)-7-(5-O-phosphono-beta-D-ribofuranosyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one
Last Modified16 May 2008
DownloadsMolfile
FormulaC12H18N5O8P
Net Charge0
Average Mass391.277
Monoisotopic Mass391.08930
SMILES[H]O[C@@]1([H])[C@@]([H])(O[H])[C@]([H])(n2c([H])c(C([H])([H])N([H])[H])c3c(=O)n([H])c(N([H])[H])nc32)O[C@]1([H])C([H])([H])OP(=O)(O[H])O[H]
InChIInChI=1S/C12H18N5O8P/c13-1-4-2-17(9-6(4)10(20)16-12(14)15-9)11-8(19)7(18)5(25-11)3-24-26(21,22)23/h2,5,7-8,11,18-19H,1,3,13H2,(H2,21,22,23)(H3,14,15,16,20)/t5-,7-,8-,11-/m1/s1
InChIKeyGIQSPNMTDJCDKB-IOSLPCCCSA-N
ChEBI Ontology
Outgoing Relation(s)
2-amino-5-(aminomethyl)-7-(5-O-phosphono-β-D-ribofuranosyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one (CHEBI:45140) is a N-glycosylpyrrolopyrimidine (CHEBI:48036)
2-amino-5-(aminomethyl)-7-(5-O-phosphono-β-D-ribofuranosyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-one (CHEBI:45140) is a ribose monophosphate (CHEBI:35159)
Synonyms  Source
PHOSPHORIC ACID MONO-[5-(2-AMINO-5-AMINOMETHYL-4-OXO-3,5-DIHYDRO-4H-PYRIDO[2,3-D]PYRIMIDIN-8-YL)-3,4-DIHYDROXY-TETRAHYDRO-FURAN-2-YLMETHYL] ESTERPDBeChem
2-amino-5-(aminomethyl)-7-(5-O-phosphono-beta-D-ribofuranosyl)-3,7-dihydro-4H-pyrrolo[2,3-d]pyrimidin-4-onePDBeChem
Manual XrefsDatabases
PQ1PDBeChem