CHEBI:181427 - Adenosine 5'-monophosphate monohydrate

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ChEBI Name Adenosine 5'-monophosphate monohydrate
ChEBI ID CHEBI:181427
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C10H14N5O7P.H2O
Net Charge 0
Average Mass 365.239
Monoisotopic Mass 365.07365
InChI InChI=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
InChIKey ZOEFQKVADUBYKV-MCDZGGTQSA-N
SMILES P(OC[C@H]1O[C@@H](N2C3=NC=NC(N)=C3N=C2)[C@H](O)[C@@H]1O)(O)(O)=O.O
ChEBI Ontology
Outgoing 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 Xref Database
4925569 ChemSpider
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