Ethyl (3R,5Z)-3-hydroxy-5-octenoate (CHEBI:171969)

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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	Ethyl (3R,5Z)-3-hydroxy-5-octenoate

ChEBI ID	CHEBI:171969

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C10H18O3

Net Charge

Average Mass

186.251

Monoisotopic Mass

186.12559

InChI

InChI=1S/C10H18O3/c1-3-5-6-7-9(11)8-10(12)13-4-2/h5-6,9,11H,3-4,7-8H2,1-2H3/b6-5-

InChIKey

UIWVSNIRNXLEKC-WAYWQWQTSA-N

SMILES

OC(C/C=C\CC)CC(OCC)=O

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in Pooled sample (NCIT:C45910). of strain [] See: MetaboLights Study
Homo sapiens (NCBI:txid9606)	Found in blood plasma (BTO:0000131). of strain [] See: MetaboLights Study

ChEBI Ontology
Outgoing	Ethyl (3R,5Z)-3-hydroxy-5-octenoate (CHEBI:171969) is a aliphatic alcohol (CHEBI:2571)

IUPAC Name

ethyl (Z)-3-hydroxyoct-5-enoate