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CHEBI:214990 - Heterocornol A

ChEBI IDCHEBI:214990
ChEBI NameHeterocornol A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O4
Net Charge0
Average Mass224.256
Monoisotopic Mass224.10486
SMILESC[C@@H](O)[C@H](O)CCc1cccc(O)c1C=O
InChIInChI=1S/C12H16O4/c1-8(14)11(15)6-5-9-3-2-4-12(16)10(9)7-13/h2-4,7-8,11,14-16H,5-6H2,1H3/t8-,11-/m1/s1
InChIKeyAVCULLXNARTUHA-LDYMZIIASA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis heterocornis (ncbitaxon:285113) - PubMed (28675830)
ChEBI Ontology
Outgoing Relation(s)
Heterocornol A (CHEBI:214990) is a hydroxybenzaldehyde (CHEBI:24673)
IUPAC Name 
2-[(3R,4R)-3,4-dihydroxypentyl]-6-hydroxybenzaldehyde
Manual XrefsDatabases
63002648ChemSpider