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CHEBI:186972 - Dihydroxychaulmoogric acid

ChEBI IDCHEBI:186972
ChEBI NameDihydroxychaulmoogric acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H32O4
Net Charge0
Average Mass312.450
Monoisotopic Mass312.23006
SMILESO=C(O)CCCCCCCCCCCCC1CCC(O)=C1O
InChIInChI=1S/C18H32O4/c19-16-14-13-15(18(16)22)11-9-7-5-3-1-2-4-6-8-10-12-17(20)21/h15,19,22H,1-14H2,(H,20,21)
InChIKeyAVUCHZPQKYTWLG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Dihydroxychaulmoogric acid (CHEBI:186972) is a long-chain fatty acid (CHEBI:15904)
IUPAC Name 
13-(2,3-dihydroxycyclopent-2-en-1-yl)tridecanoic acid
Manual XrefsDatabases
113368361ChemSpider
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