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CHEBI:214964 - Heterocornol I

ChEBI IDCHEBI:214964
ChEBI NameHeterocornol I
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O4
Net Charge0
Average Mass292.375
Monoisotopic Mass292.16746
SMILESCC(C)=CCc1ccc(O)c2c1[C@H](C[C@@H](O)[C@H](C)O)OC2
InChIInChI=1S/C17H24O4/c1-10(2)4-5-12-6-7-14(19)13-9-21-16(17(12)13)8-15(20)11(3)18/h4,6-7,11,15-16,18-20H,5,8-9H2,1-3H3/t11-,15+,16-/m0/s1
InChIKeyJUJNVXXKTUEQPG-XZJROXQQSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis heterocornis (ncbitaxon:285113) - PubMed (28675830)
ChEBI Ontology
Outgoing Relation(s)
Heterocornol I (CHEBI:214964) is a 2-benzofurans (CHEBI:38831)
IUPAC Name 
(2R,3S)-1-[(1S)-4-hydroxy-7-(3-methylbut-2-enyl)-1,3-dihydro-2-benzouran-1-yl]butane-2,3-diol
Manual XrefsDatabases
62285133ChemSpider