EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:181427 - Adenosine 5'-monophosphate monohydrate

ChEBI IDCHEBI:181427
ChEBI NameAdenosine 5'-monophosphate monohydrate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H14N5O7P.H2O
Net Charge0
Average Mass365.239
Monoisotopic Mass365.07365
SMILESNc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]1O.O
InChIInChI=1S/C10H14N5O7P.H2O/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20;/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20);1H2/t4-,6-,7-,10-;/m1./s1
InChIKeyZOEFQKVADUBYKV-MCDZGGTQSA-N
ChEBI Ontology
Outgoing Relation(s)
Adenosine 5'-monophosphate monohydrate (CHEBI:181427) is a purine ribonucleoside monophosphate (CHEBI:26397)
IUPAC Name 
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate;hydrate
Manual XrefsDatabases
4925569ChemSpider