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CHEBI:197215 - PIM1(18:2(9Z,12Z)/18:1(9Z))

ChEBI IDCHEBI:197215
ChEBI NamePIM1(18:2(9Z,12Z)/18:1(9Z))
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC51H91O18P
Net Charge0
Average Mass1023.245
Monoisotopic Mass1022.59430
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)O[C@@H]1C(O)C(O)[C@@H](O)C(O)[C@H]1O[C@H]1OC(CO)[C@@H](O)C(O)[C@H]1O)OC(=O)CCCCCCC/C=C\CCCCCCCC
InChIInChI=1S/C51H91O18P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(53)64-36-38(66-41(54)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)37-65-70(62,63)69-50-47(60)45(58)44(57)46(59)49(50)68-51-48(61)43(56)42(55)39(35-52)67-51/h11,13,17-20,38-39,42-52,55-61H,3-10,12,14-16,21-37H2,1-2H3,(H,62,63)/b13-11-,19-17-,20-18-/t38-,39?,42-,43?,44-,45?,46?,47?,48-,49-,50-,51-/m1/s1
InChIKeyGSNPRBBRNYSAQM-QYPGKCRPSA-N
Species of MetaboliteComponentSourceComments
Cannabis sativa (ncbitaxon:3483) inflorescence (BTO:0000628) MetaboLights (MTBLS6032) Strain: Cannabis sativa var. DMG265
Roles Classification
Biological Role:
antigen  Any substance that stimulates an immune response in the body, such as through antibody production or by presentation to a T-cell receptor after binding to a major histocompability complex (MHC).
ChEBI Ontology
Outgoing Relation(s)
PIM1(18:2(9Z,12Z)/18:1(9Z)) (CHEBI:197215) is a phosphatidylinositol mannoside (CHEBI:59466)
IUPAC Name 
[(2R)-1-[hydroxy-[(1R,4R,6R)-2,3,4,5-tetrahydroxy-6-[(2R,3R,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexyl]oxyphosphoryl]oxy-3-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropan-2-yl] (Z)-octadec-9-enoate
Manual XrefsDatabases
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