CHEBI:231191 - 10-Oxo-11-octadecen-13-olide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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-Oxo-11-octadecen-13-olide
ChEBI ID CHEBI:231191
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C18H30O3
Net Charge 0
Average Mass 294.435
Monoisotopic Mass 294.21949
InChI InChI=1S/C18H30O3/c1-2-3-8-12-17-15-14-16(19)11-9-6-4-5-7-10-13-18(20)21-17/h14-15,17H,2-13H2,1H3/b15-14+
InChIKey SSQZBGJHGPTSLK-CCEZHUSRSA-N
SMILES O1C(CCCCC)C=CC(=O)CCCCCCCCC1=O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). See: MetaboLights Study
ChEBI Ontology
Outgoing 10-Oxo-11-octadecen-13-olide (CHEBI:231191) is a macrolide (CHEBI:25106)
IUPAC Name
(12E)-14-pentyl-1-oxacyclotetradec-12-ene-2,11-dione
Manual Xrefs Databases
8058274 ChemSpider
HMDB0029786 HMDB
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