CHEBI:192883 - [10]-Shogaol

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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 [10]-Shogaol
ChEBI ID CHEBI:192883
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H32O3
Net Charge 0
Average Mass 332.484
Monoisotopic Mass 332.23514
InChI InChI=1S/C21H32O3/c1-3-4-5-6-7-8-9-10-11-12-19(22)15-13-18-14-16-20(23)21(17-18)24-2/h11-12,14,16-17,23H,3-10,13,15H2,1-2H3/b12-11+
InChIKey FADFGCOCHHNRHF-VAWYXSNFSA-N
SMILES O=C(\C=C\CCCCCCCCC)CCC1=CC(OC)=C(O)C=C1
Metabolite of Species Details
Cryptomeria (NCBI:txid3368) Found in needle (BTO:0000917). of strain Cryptomeria fortunei Hooibrenk See: MetaboLights Study
ChEBI Ontology
Outgoing [10]-Shogaol (CHEBI:192883) is a enone (CHEBI:51689)
[10]-Shogaol (CHEBI:192883) is a monomethoxybenzene (CHEBI:25235)
[10]-Shogaol (CHEBI:192883) is a phenols (CHEBI:33853)
IUPAC Name
(E)-1-(4-hydroxy-3-methoxyphenyl)tetradec-4-en-3-one
Manual Xrefs Databases
4946680 ChemSpider
HMDB0031462 HMDB
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Registry Number Type Source
36752-54-2 CAS Registry Number ChemIDplus