EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C43H81O13P |
| Net Charge | 0 |
| Average Mass | 837.082 |
| Monoisotopic Mass | 836.54148 |
| SMILES | CCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O)OC(=O)CCCCCCCCCCCCCCCCCC |
| InChI | InChI=1S/C43H81O13P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-37(45)55-35(33-53-36(44)31-29-27-25-23-21-16-14-12-10-8-6-4-2)34-54-57(51,52)56-43-41(49)39(47)38(46)40(48)42(43)50/h12,14,35,38-43,46-50H,3-11,13,15-34H2,1-2H3,(H,51,52)/b14-12-/t35-,38?,39-,40?,41?,42?,43?/m1/s1 |
| InChIKey | LMUIULYUEZGDTB-LTGDPXNMSA-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) |
| PI(15:1(9Z)/19:0) (CHEBI:185369) is a phosphatidylinositol (CHEBI:28874) |
| IUPAC Name |
|---|
| [(2R)-1-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxy-3-[(Z)-pentadec-9-enoyl]oxypropan-2-yl] nonadecanoate |
| Manual Xrefs | Databases |
|---|---|
| LMGP06010146 | LIPID MAPS |