CHEBI:167836 - Sorbicillin

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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 Sorbicillin
ChEBI ID CHEBI:167836
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H16O3
Net Charge 0
Average Mass 232.279
Monoisotopic Mass 232.10994
InChI InChI=1S/C14H16O3/c1-4-5-6-7-12(15)11-8-9(2)13(16)10(3)14(11)17/h4-8,16-17H,1-3H3/b5-4+,7-6+
InChIKey RKKPUBAAIGFXOG-YTXTXJHMSA-N
SMILES O=C(C1=C(O)C(=C(O)C(=C1)C)C)/C=C/C=C/C
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood serum (BTO:0000133). See: MetaboLights Study
ChEBI Ontology
Outgoing Sorbicillin (CHEBI:167836) is a phenols (CHEBI:33853)
IUPAC Name
(2E,4E)-1-(2,4-dihydroxy-3,5-dimethylphenyl)hexa-2,4-dien-1-one
Manual Xref Database
4525514 ChemSpider
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Registry Number Type Source
79950-85-9 CAS Registry Number ChemIDplus