CHEBI:230749 - 2-Hydroxypropyl octanoate

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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 2-Hydroxypropyl octanoate
ChEBI ID CHEBI:230749
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C11H22O3
Net Charge 0
Average Mass 202.294
Monoisotopic Mass 202.15689
InChI InChI=1S/C11H22O3/c1-3-4-5-6-7-8-11(13)14-9-10(2)12/h10,12H,3-9H2,1-2H3
InChIKey GHHURQMJLARIDK-UHFFFAOYSA-N
SMILES O(C(=O)CCCCCCC)CC(O)C
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Found in feces (BTO:0000440). See: MetaboLights Study
ChEBI Ontology
Outgoing 2-Hydroxypropyl octanoate (CHEBI:230749) is a fatty acid ester (CHEBI:35748)
IUPAC Name
2-hydroxypropyl octanoate
Manual Xrefs Databases
98275 ChemSpider
HMDB0245164 HMDB
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