CHEBI:178358 - PA(13:0/19:0)

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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(13:0/19:0)
ChEBI ID CHEBI:178358
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000058638841
Download Molfile XML SDF
Formula C35H69O8P
Net Charge 0
Average Mass 648.903
Monoisotopic Mass 648.47301
InChI InChI=1S/C35H69O8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-30-35(37)43-33(32-42-44(38,39)40)31-41-34(36)29-27-25-23-21-14-12-10-8-6-4-2/h33H,3-32H2,1-2H3,(H2,38,39,40)/t33-/m1/s1
InChIKey VCPITZIBBDMDMY-MGBGTMOVSA-N
SMILES P(OC[C@H](OC(=O)CCCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCC)(O)(O)=O
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(13:0/19:0) (CHEBI:178358) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name
[(2R)-1-phosphonooxy-3-tridecanoyloxypropan-2-yl] nonadecanoate
Manual Xref Database
LMGP10010936 LIPID MAPS
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