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CHEBI:180051 - PE(MonoMe(11,3)/DiMe(9,5))

ChEBI IDCHEBI:180051
ChEBI NamePE(MonoMe(11,3)/DiMe(9,5))
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FormulaC44H76NO10P
Net Charge0
Average Mass810.063
Monoisotopic Mass809.52068
SMILESCCCCCc1oc(CCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCc2oc(CCC)cc2C)COP(=O)(O)OCCN)c(C)c1C
InChIInChI=1S/C44H76NO10P/c1-6-8-19-26-41-36(4)37(5)42(55-41)27-21-16-13-14-18-23-29-44(47)54-39(34-52-56(48,49)51-31-30-45)33-50-43(46)28-22-17-12-10-9-11-15-20-25-40-35(3)32-38(53-40)24-7-2/h32,39H,6-31,33-34,45H2,1-5H3,(H,48,49)/t39-/m1/s1
InChIKeyIBLHROXOYXNZKK-LDLOPFEMSA-N
ChEBI Ontology
Outgoing Relation(s)
PE(MonoMe(11,3)/DiMe(9,5)) (CHEBI:180051) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[9-(3,4-dimethyl-5-pentyluran-2-yl)nonanoyloxy]propyl] 11-(3-methyl-5-propyluran-2-yl)undecanoate
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59662800ChemSpider
HMDB0061520HMDB