CHEBI:218411 - Pelopurin B

ChEBI IDCHEBI:218411
ChEBI NamePelopurin B
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SubmitterMetaboLights
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FormulaC10H14N2O4
Net Charge0
Average Mass226.232
Monoisotopic Mass226.09536
SMILESO=C1N2CCC[C@]2(O)C(=O)N2CCC[C@]12O
InChIInChI=1S/C10H14N2O4/c13-7-9(15)3-1-5-11(9)8(14)10(16)4-2-6-12(7)10/h15-16H,1-6H2/t9-,10-/m0/s1
InChIKeyPGWYJRAHWPKIEV-UWVGGRQHSA-N
Species of MetaboliteComponentSourceComments
Pelomonas puraquae (ncbitaxon:431059) - PubMed (24597911)
ChEBI Ontology
Outgoing Relation(s)
Pelopurin B (CHEBI:218411) has functional parent α-amino acid (CHEBI:33704)
Pelopurin B (CHEBI:218411) is a organonitrogen compound (CHEBI:35352)
Pelopurin B (CHEBI:218411) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3S,9S)-3,9-dihydroxy-1,7-diazatricyclo[7.3.0.03,7]dodecane-2,8-dione
Manual XrefsDatabases
32675013ChemSpider