CHEBI:193362 - OS-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 OS-PA
ChEBI ID CHEBI:193362
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000058638841
Download Molfile XML SDF
Formula C25H45O10P
Net Charge 0
Average Mass 536.599
Monoisotopic Mass 536.27503
InChI InChI=1S/C25H45O10P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(28)33-20-22(21-34-36(30,31)32)35-25(29)19-18-23(26)27/h9-10,22H,2-8,11-21H2,1H3,(H,26,27)(H2,30,31,32)/b10-9-/t22-/m1/s1
InChIKey YXLMBHUIKSDLSM-MZMPXXGTSA-N
SMILES P(OC[C@H](OC(=O)CCC(O)=O)COC(=O)CCCCCCC/C=C\CCCCCCCC)(O)(O)=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in feces (BTO:0000440). 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 OS-PA (CHEBI:193362) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name
4-[(2R)-1-[(Z)-octadec-9-enoyl]oxy-3-phosphonooxypropan-2-yl]oxy-4-oxobutanoic acid
Manual Xrefs Databases
113381007 ChemSpider
LMGP20070020 LIPID MAPS
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