EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C32H57O14P |
| Net Charge | 0 |
| Average Mass | 696.768 |
| Monoisotopic Mass | 696.34859 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O)OC(=O)CCCC=O |
| InChI | InChI=1S/C32H57O14P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-25(34)43-22-24(45-26(35)20-17-18-21-33)23-44-47(41,42)46-32-30(39)28(37)27(36)29(38)31(32)40/h9-10,21,24,27-32,36-40H,2-8,11-20,22-23H2,1H3,(H,41,42)/b10-9-/t24-,27?,28-,29?,30?,31?,32?/m1/s1 |
| InChIKey | TVCNWNLUPBEENB-GMALVADASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS3750) | Strain: C57BL/6 Mouse [NCIT:C14424] |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| OOV-PI (CHEBI:185534) is a phosphatidylinositol (CHEBI:28874) |
| IUPAC Name |
|---|
| [(2R)-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-2-(5-oxopentanoyloxy)propyl] (Z)-octadec-9-enoate |
| Manual Xrefs | Databases |
|---|---|
| LMGP20050022 | LIPID MAPS |