Oleoyl 3-carbacyclic Phosphatidic Acid (CHEBI:185825)

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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	Oleoyl 3-carbacyclic Phosphatidic Acid

ChEBI ID	CHEBI:185825

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C22H41O5P

Net Charge

Average Mass

416.539

Monoisotopic Mass

416.26916

InChI

InChI=1S/C22H41O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(23)26-20-21-18-19-28(24,25)27-21/h9-10,21H,2-8,11-20H2,1H3,(H,24,25)/b10-9-

InChIKey

IJSTZKWSILWQEC-KTKRTIGZSA-N

SMILES

P1(OC(CC1)COC(=O)CCCCCCC/C=C\CCCCCCCC)(O)=O

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in feces (BTO:0000440). of strain C57BL/6 Mouse [NCIT:C14424] See: MetaboLights Study

ChEBI Ontology
Outgoing	Oleoyl 3-carbacyclic Phosphatidic Acid (CHEBI:185825) is a fatty acid ester (CHEBI:35748)

IUPAC Name

(2-hydroxy-2-oxo-1,2lambda5-oxaphospholan-5-yl)methyl (Z)-octadec-9-enoate