CHEBI:171786 - Terpinyl isobutyrate

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ChEBI Name Terpinyl isobutyrate
ChEBI ID CHEBI:171786
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C14H24O2
Net Charge 0
Average Mass 224.344
Monoisotopic Mass 224.17763
InChI InChI=1S/C14H24O2/c1-10(2)13(15)16-14(4,5)12-8-6-11(3)7-9-12/h6,10,12H,7-9H2,1-5H3
InChIKey SMQUXKIIXFOJKI-UHFFFAOYSA-N
SMILES O(C(C1CCC(=CC1)C)(C)C)C(=O)C(C)C
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 Terpinyl isobutyrate (CHEBI:171786) is a p-menthane monoterpenoid (CHEBI:25186)
IUPAC Name
2-(4-methylcyclohex-3-en-1-yl)propan-2-yl 2-methylpropanoate
Manual Xrefs Databases
455931 ChemSpider
HMDB0032524 HMDB
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Registry Number Type Source
7774-65-4 CAS Registry Number ChemIDplus