EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C51H101O8P |
| Net Charge | 0 |
| Average Mass | 873.335 |
| Monoisotopic Mass | 872.72341 |
| SMILES | CC(C)CCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)O)OC(=O)CCCCCCCCCCCCCCCCCCCCC(C)C |
| InChI | InChI=1S/C51H101O8P/c1-47(2)41-37-33-29-25-21-17-13-9-5-7-11-15-19-23-27-31-35-39-43-50(52)57-45-49(46-58-60(54,55)56)59-51(53)44-40-36-32-28-24-20-16-12-8-6-10-14-18-22-26-30-34-38-42-48(3)4/h47-49H,5-46H2,1-4H3,(H2,54,55,56)/t49-/m1/s1 |
| InChIKey | KDLORLVLUHSHGM-ANFMRNGASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bos taurus (ncbitaxon:9913) | spermatozoon (BTO:0001277) | MetaboLights (MTBLS1071) | Strain: Holstein [LBO:0000132] |
| Roles Classification |
|---|
| Biological Role: | Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [(2R)-2,3-bis[(22-methyltricosanoyl)oxy]propoxy]phosphonic acid (CHEBI:184970) is a 1,2-diacyl-sn-glycerol 3-phosphate (CHEBI:29089) |
| IUPAC Name |
|---|
| [(2R)-2-(22-methyltricosanoyloxy)-3-phosphonooxypropyl] 22-methyltricosanoate |
| Manual Xrefs | Databases |
|---|---|
| 74877687 | ChemSpider |
| HMDB0115949 | HMDB |