CHEBI:196652 - PA(12:0/17:0)

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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(12:0/17:0)
ChEBI ID CHEBI:196652
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C32H63O8P
Net Charge 0
Average Mass 606.822
Monoisotopic Mass 606.42606
InChI InChI=1S/C32H63O8P/c1-3-5-7-9-11-13-14-15-16-17-19-21-23-25-27-32(34)40-30(29-39-41(35,36)37)28-38-31(33)26-24-22-20-18-12-10-8-6-4-2/h30H,3-29H2,1-2H3,(H2,35,36,37)/t30-/m1/s1
InChIKey YGGDERMVNQITHI-SSEXGKCCSA-N
SMILES P(OC[C@H](OC(=O)CCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCC)(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(12:0/17:0) (CHEBI:196652) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089)
IUPAC Name
[(2R)-1-dodecanoyloxy-3-phosphonooxypropan-2-yl] heptadecanoate
Manual Xrefs Databases
113378839 ChemSpider
LMGP10010048 LIPID MAPS
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