CHEBI:171851 - Citronellyl pentanoate

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ChEBI Name Citronellyl pentanoate
ChEBI ID CHEBI:171851
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C15H28O2
Net Charge 0
Average Mass 240.387
Monoisotopic Mass 240.20893
InChI InChI=1S/C15H28O2/c1-5-6-10-15(16)17-12-11-14(4)9-7-8-13(2)3/h8,14H,5-7,9-12H2,1-4H3
InChIKey PFOJEJPZUVQHEH-UHFFFAOYSA-N
SMILES O(CCC(CCC=C(C)C)C)C(=O)CCCC
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606) Found in Pooled sample (NCIT:C45910). of strain [] See: MetaboLights Study
ChEBI Ontology
Outgoing Citronellyl pentanoate (CHEBI:171851) is a carboxylic ester (CHEBI:33308)
IUPAC Name
3,7-dimethyloct-6-enyl pentanoate
Manual Xrefs Databases
55342 ChemSpider
HMDB0037229 HMDB
LMFA07010819 LIPID MAPS
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Registry Number Type Source
7540-53-6 CAS Registry Number ChemIDplus