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Details of Purine

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Role Analyte
namePurine
MPIMP IDA153016
isotopomerambient
formulaC5H4N4
molecular mass120.112
monoisotopic mass120.04359
InChIInChI=1S/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9)
InChIKeyKDCGOANMDULRCW-UHFFFAOYSA-N
substructure TMS0
substructure TBS0
substructure H3ON0
substructure CH3O0
retention index (VAR5 method, n-alkanes C10–C36)1,536.38
application/atom+xmlhttp://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Analyte(guid%271a6db7c2-2ea6-42e1-b6ec-c3cc62c53d21%27)

Synonyms of Purine

propertyvalue
BRENDA20835
ChEBI IDChEBI:17258
ChEBI ontologyis a purine
ChEBI ontologyis tautomer of 1H-purine
ChEBI ontologyis tautomer of 3H-purine
ChEBI ontologyis tautomer of 9H-purine
ChemSpider ID1015
MetaCycPURINE
PubChem CID1044
PubChem SID92298424
13 synonym(s)
    of 2    

Metabolite mapped to Purine

metabolitestereoisomerisotopomer
Purine  ambient
1 metabolite(s)

Reference spectra of Purine

replicaentry datedetectionmethodspecies
17/19/2007 11:16:30 AM VAR5Reference Substance
1 spectrum(a)
compound timestamp information
deposited at 7/16/2007 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed at 8/7/2013 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users Strehmel N., Hummel J.
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