CHEBI:216020 - 2-(2′, 3′-dihydrosorbyl)-3,6-dimethyl-5-hydroxy-1,4-benzoquinone

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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 2-(2′, 3′-dihydrosorbyl)-3,6-dimethyl-5-hydroxy-1,4-benzoquinone
ChEBI ID CHEBI:216020
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H16O4
Net Charge 0
Average Mass 248.278
Monoisotopic Mass 248.10486
InChI InChI=1S/C14H16O4/c1-4-5-6-7-10(15)11-8(2)13(17)14(18)9(3)12(11)16/h4-5,16H,6-7H2,1-3H3/b5-4+
InChIKey AXEZOCXIWCSNHL-SNAWJCMRSA-N
SMILES O=C1C(=O)C(=C(C(=O)CC/C=C/C)C(=C1C)O)C
Metabolite of Species Details
Penicillium terrestre (NCBI:txid374132) See: PubMed
ChEBI Ontology
Outgoing 2-(2′, 3′-dihydrosorbyl)-3,6-dimethyl-5-hydroxy-1,4-benzoquinone (CHEBI:216020) is a benzoquinones (CHEBI:22729)
2-(2′, 3′-dihydrosorbyl)-3,6-dimethyl-5-hydroxy-1,4-benzoquinone (CHEBI:216020) is a orthoquinones (CHEBI:25622)
IUPAC Name
4-[(E)-hex-4-enoyl]-5-hydroxy-3,6-dimethylcyclohexa-3,5-diene-1,2-dione
Manual Xref Database
9992147 ChemSpider
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