CHEBI:172012 - (S,E)-Filbertone

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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 (S,E)-Filbertone
ChEBI ID CHEBI:172012
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C8H14O
Net Charge 0
Average Mass 126.199
Monoisotopic Mass 126.10447
InChI InChI=1S/C8H14O/c1-4-6-8(9)7(3)5-2/h4,6-7H,5H2,1-3H3/b6-4-
InChIKey ARJWAURHQDJJAC-XQRVVYSFSA-N
SMILES O=C(C(CC)C)/C=C\C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in Pooled sample (NCIT:C45910). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing (S,E)-Filbertone (CHEBI:172012) is a enone (CHEBI:51689)
IUPAC Name
(Z)-5-methylhept-2-en-4-one
Manual Xrefs Databases
35013882 ChemSpider
HMDB0035242 HMDB
View more database links
Registry Number Type Source
103070-07-1 CAS Registry Number ChemIDplus