CHEBI:218411 - Pelopurin B

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Pelopurin B
ChEBI ID CHEBI:218411
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C10H14N2O4
Net Charge 0
Average Mass 226.232
Monoisotopic Mass 226.09536
InChI InChI=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
InChIKey PGWYJRAHWPKIEV-UWVGGRQHSA-N
SMILES O=C1N2[C@@](O)(C(=O)N3[C@]1(O)CCC3)CCC2
Metabolite of Species Details
Pelomonas puraquae (NCBI:txid431059) See: PubMed
ChEBI Ontology
Outgoing 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 Xref Database
32675013 ChemSpider
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