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CHEBI:196986 - PI-Cer(d20:0/26:0)

ChEBI IDCHEBI:196986
ChEBI NamePI-Cer(d20:0/26:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC52H104NO11P
Net Charge0
Average Mass950.374
Monoisotopic Mass949.73470
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP(=O)(O)OC1C(O)C(O)C(O)[C@@H](O)C1O)[C@H](O)CCCCCCCCCCCCCCCCC
InChIInChI=1S/C52H104NO11P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-42-46(55)53-44(43-63-65(61,62)64-52-50(59)48(57)47(56)49(58)51(52)60)45(54)41-39-37-35-33-31-29-27-18-16-14-12-10-8-6-4-2/h44-45,47-52,54,56-60H,3-43H2,1-2H3,(H,53,55)(H,61,62)/t44-,45+,47?,48+,49?,50?,51?,52?/m0/s1
InChIKeyHEMBZZZIBPHUNE-MMZOMUCESA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
ChEBI Ontology
Outgoing Relation(s)
PI-Cer(d20:0/26:0) (CHEBI:196986) is a phosphosphingolipid (CHEBI:35786)
IUPAC Name 
[(2S,3R)-2-(hexacosanoylamino)-3-hydroxyicosyl] [(5R)-2,3,4,5,6-pentahydroxycyclohexyl] hydrogen phosphate
Manual XrefsDatabases
LMSP03030029LIPID MAPS