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CHEBI:187575 - beta-Dolabrin

ChEBI IDCHEBI:187575
ChEBI Namebeta-Dolabrin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10O2
Net Charge0
Average Mass162.188
Monoisotopic Mass162.06808
SMILESC=C(C)c1cccc(O)c(=O)c1
InChIInChI=1S/C10H10O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-6H,1H2,2H3,(H,11,12)
InChIKeyZXPADFNEYYDQFL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
beta-Dolabrin (CHEBI:187575) is a cyclic ketone (CHEBI:3992)
IUPAC Name 
2-hydroxy-6-prop-1-en-2-ylcyclohepta-2,4,6-trien-1-one
Manual XrefsDatabases
164209ChemSpider
Registry NumbersSources
CAS:4570-11-0ChemIDplus