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CHEBI:223570 - Alutacenoic acid A

ChEBI IDCHEBI:223570
ChEBI NameAlutacenoic acid A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC9H12O3
Net Charge0
Average Mass168.192
Monoisotopic Mass168.07864
SMILESO=C(O)CCCCCc1cc1=O
InChIInChI=1S/C9H12O3/c10-8-6-7(8)4-2-1-3-5-9(11)12/h6H,1-5H2,(H,11,12)
InChIKeyPILZQFAVBOKECT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mycobacterium tuberculosis (ncbitaxon:1773) - DOI (10.1021/ja992355s)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Alutacenoic acid A (CHEBI:223570) is a medium-chain fatty acid (CHEBI:59554)
IUPAC Name 
6-(3-oxocyclopropen-1-yl)hexanoic acid
Manual XrefsDatabases
9994065ChemSpider