CHEBI:215015 - Heterocornol E

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Heterocornol E
ChEBI ID CHEBI:215015
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C12H14O3
Net Charge 0
Average Mass 206.241
Monoisotopic Mass 206.09429
InChI InChI=1S/C12H14O3/c1-7-10-6-5-8-3-2-4-9(13)11(8)12(14-7)15-10/h2-4,7,10,12-13H,5-6H2,1H3/t7-,10+,12-/m0/s1
InChIKey ORAZICTVJWVQCF-KOLSJAJHSA-N
SMILES O1[C@@H]2O[C@H]([C@H]1CCC=3C2=C(O)C=CC3)C
Metabolite of Species Details
Pestalotiopsis heterocornis (NCBI:txid285113) See: PubMed
ChEBI Ontology
Outgoing Heterocornol E (CHEBI:215015) is a phenols (CHEBI:33853)
IUPAC Name
(1S,10R,11S)-11-methyl-12,13-dioxatricyclo[8.2.1.02,7]trideca-2(7),3,5-trien-3-ol
Manual Xref Database
63002651 ChemSpider
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