CHEBI:168159 - Nemotinic acid

ChEBI IDCHEBI:168159
ChEBI NameNemotinic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H10O3
Net Charge0
Average Mass190.198
Monoisotopic Mass190.06299
SMILESC#CC#CC=C=CC(O)CCC(=O)O
InChIInChI=1S/C11H10O3/c1-2-3-4-5-6-7-10(12)8-9-11(13)14/h1,5,7,10,12H,8-9H2,(H,13,14)
InChIKeyDOCWUDHOAPAYAN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Nemotinic acid (CHEBI:168159) is a carbonyl compound (CHEBI:36586)
Manual XrefsDatabases
2299561ChemSpider
Registry NumbersSources
CAS:539-98-0ChemIDplus