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CHEBI:172429 - Pyrocoll

ChEBI IDCHEBI:172429
ChEBI NamePyrocoll
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H6N2O2
Net Charge0
Average Mass186.170
Monoisotopic Mass186.04293
SMILESO=c1c2cccn2c(=O)c2cccn12
InChIInChI=1S/C10H6N2O2/c13-9-7-3-1-5-11(7)10(14)8-4-2-6-12(8)9/h1-6H
InChIKeyUSCZWOZHDDOBHQ-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
Pyrocoll (CHEBI:172429) is a pyrrolopyrazine (CHEBI:48337)
IUPAC Name 
1,7-diazatricyclo[7.3.0.03,7]dodeca-3,5,9,11-tetraene-2,8-dione
Manual XrefsDatabases
8417014ChemSpider
HMDB0033163HMDB
Registry NumbersSources
CAS:484-73-1ChemIDplus