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CHEBI:197196 - PA(12:0/16:1(9Z))
| Formula | C31H59O8P |
| Net Charge | 0 |
| Average Mass | 590.779 |
| Monoisotopic Mass | 590.39476 |
| SMILES | CCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC)COP(=O)(O)O |
| InChI | InChI=1S/C31H59O8P/c1-3-5-7-9-11-13-14-15-16-18-20-22-24-26-31(33)39-29(28-38-40(34,35)36)27-37-30(32)25-23-21-19-17-12-10-8-6-4-2/h13-14,29H,3-12,15-28H2,1-2H3,(H2,34,35,36)/b14-13-/t29-/m1/s1 |
| InChIKey | UARCTMUVJALMHM-FOIMXDHRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Cannabis sativa (ncbitaxon:3483) | inflorescence (BTO:0000628) | MetaboLights (MTBLS6032) | Strain: Cannabis sativa var. DMG265 |
| Roles Classification |
|---|
| Biological Role: | Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| PA(12:0/16:1(9Z)) (CHEBI:197196) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089) |
| IUPAC Name |
|---|
| [(2R)-1-dodecanoyloxy-3-phosphonooxypropan-2-yl] (Z)-hexadec-9-enoate |
| Manual Xrefs | Databases |
|---|---|
| 30779191 | ChemSpider |
| LMGP10010047 | LIPID MAPS |