CHEBI:184685 - OOV-PA

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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 OOV-PA
ChEBI ID CHEBI:184685
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H47O9P
Net Charge 0
Average Mass 534.627
Monoisotopic Mass 534.29577
InChI InChI=1S/C26H47O9P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25(28)33-22-24(23-34-36(30,31)32)35-26(29)20-17-18-21-27/h9-10,21,24H,2-8,11-20,22-23H2,1H3,(H2,30,31,32)/b10-9-/t24-/m1/s1
InChIKey JHXBXWDXAHPHCM-OPSAWKISSA-N
SMILES P(OC[C@H](OC(=O)CCCC=O)COC(=O)CCCCCCC/C=C\CCCCCCCC)(O)(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
Roles Classification
Biological Role(s): Escherichia coli metabolite
Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
(via phosphatidic acid )
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ChEBI Ontology
Outgoing OOV-PA (CHEBI:184685) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name
[(2R)-2-(5-oxopentanoyloxy)-3-phosphonooxypropyl] (Z)-octadec-9-enoate
Manual Xrefs Databases
113381009 ChemSpider
LMGP20070022 LIPID MAPS
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