CHEBI:194563 - PA(12:0/14:1(9Z))

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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 PA(12:0/14:1(9Z))
ChEBI ID CHEBI:194563
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C29H55O8P
Net Charge 0
Average Mass 562.725
Monoisotopic Mass 562.36346
InChI InChI=1S/C29H55O8P/c1-3-5-7-9-11-13-14-16-18-20-22-24-29(31)37-27(26-36-38(32,33)34)25-35-28(30)23-21-19-17-15-12-10-8-6-4-2/h9,11,27H,3-8,10,12-26H2,1-2H3,(H2,32,33,34)/b11-9-/t27-/m1/s1
InChIKey JIEKTNYKXHHALN-YLYQOIPRSA-N
SMILES P(OC[C@H](OC(=O)CCCCCCC/C=C\CCCC)COC(=O)CCCCCCCCCCC)(O)(O)=O
Metabolite of Species Details
Macaca fascicularis (NCBI:txid9541) Found in liver (BTO:0000759). 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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing PA(12:0/14:1(9Z)) (CHEBI:194563) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name
[(2R)-1-dodecanoyloxy-3-phosphonooxypropan-2-yl] (Z)-tetradec-9-enoate
Manual Xrefs Databases
113378836 ChemSpider
LMGP10010044 LIPID MAPS
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