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CHEBI:168873 - PC(5:0/5:0)

ChEBI IDCHEBI:168873
ChEBI NamePC(5:0/5:0)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H36NO8P
Net Charge0
Average Mass425.459
Monoisotopic Mass425.21785
SMILESCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCC
InChIInChI=1S/C18H36NO8P/c1-6-8-10-17(20)24-14-16(27-18(21)11-9-7-2)15-26-28(22,23)25-13-12-19(3,4)5/h16H,6-15H2,1-5H3/t16-/m1/s1
InChIKeyYCBVRDMSFWAKDH-MRXNPFEDSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
PC(5:0/5:0) (CHEBI:168873) is a 1,2-diacyl-sn-glycero-3-phosphocholine (CHEBI:57643)
IUPAC Name 
[(2R)-2,3-di(pentanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Manual XrefsDatabases
LMGP01011225LIPID MAPS
24822790ChemSpider