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CHEBI:186409 - 1-(6-[3]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
| Formula | C44H73O9P |
| Net Charge | 0 |
| Average Mass | 777.033 |
| Monoisotopic Mass | 776.49922 |
| SMILES | O=C(CCCCCC1CCC2C(C1)C1C3CCC3C21)OC[C@H](COP(=O)(O)OC[C@@H](O)CO)OCCCCCCCCC1CCC2C(C1)C1C3CCC3C21 |
| InChI | InChI=1S/C44H73O9P/c45-24-30(46)25-52-54(48,49)53-27-31(26-51-40(47)12-8-5-7-11-29-14-16-37-39(23-29)44-35-20-18-33(35)42(37)44)50-21-9-4-2-1-3-6-10-28-13-15-36-38(22-28)43-34-19-17-32(34)41(36)43/h28-39,41-46H,1-27H2,(H,48,49)/t28?,29?,30-,31+,32?,33?,34?,35?,36?,37?,38?,39?,41?,42?,43?,44?/m0/s1 |
| InChIKey | JJLVYWJOBDTSOM-NHQYVWKGSA-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) |
| 1-(6-[3]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:186409) is a ether lipid (CHEBI:64611) |
| 1-(6-[3]-ladderane-hexanoyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:186409) is a glycerophosphoglycerols (CHEBI:24360) |
| IUPAC Name |
|---|
| [(2R)-3-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-2-[8-(10-tetracyclo[6.4.0.02,7.03,6]dodecanyl)octoxy]propyl] 6-(10-tetracyclo[6.4.0.02,7.03,6]dodecanyl)hexanoate |
| Manual Xrefs | Databases |
|---|---|
| 24823110 | ChemSpider |
| LMGP04110003 | LIPID MAPS |