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CHEBI:183182 - 1-(2E,6E,10E,14E-phytatetraenyl)-2-(2E,6E,10E,14E-phytatetraenyl)-sn-glycero-3-phosphocholine

ChEBI IDCHEBI:183182
ChEBI Name1-(2E,6E,10E,14E-phytatetraenyl)-2-(2E,6E,10E,14E-phytatetraenyl)-sn-glycero-3-phosphocholine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC48H84NO6P
Net Charge0
Average Mass802.175
Monoisotopic Mass801.60363
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C/COC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C
InChIInChI=1S/C48H84NO6P/c1-40(2)20-14-22-42(5)24-16-26-44(7)28-18-30-46(9)32-35-52-38-48(39-55-56(50,51)54-37-34-49(11,12)13)53-36-33-47(10)31-19-29-45(8)27-17-25-43(6)23-15-21-41(3)4/h20-21,24-25,28-29,32-33,48H,14-19,22-23,26-27,30-31,34-39H2,1-13H3/b42-24+,43-25+,44-28+,45-29+,46-32+,47-33+/t48-/m1/s1
InChIKeyAGNLISHIUKMJPX-NHZIYRRHSA-N
Species of MetaboliteComponentSourceComments
Trypanosoma brucei (ncbitaxon:5691) cell culture (BTO:0000214) MetaboLights (MTBLS2559)
ChEBI Ontology
Outgoing Relation(s)
1-(2E,6E,10E,14E-phytatetraenyl)-2-(2E,6E,10E,14E-phytatetraenyl)-sn-glycero-3-phosphocholine (CHEBI:183182) is a diterpenoid (CHEBI:23849)
IUPAC Name 
[(2R)-2,3-bis[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraenoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
LMGP01040095LIPID MAPS
24822996ChemSpider