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CHEBI:180044 - PE(DiMe(11,3)/MonoMe(11,3))

ChEBI IDCHEBI:180044
ChEBI NamePE(DiMe(11,3)/MonoMe(11,3))
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FormulaC44H76NO10P
Net Charge0
Average Mass810.063
Monoisotopic Mass809.52068
SMILESCCCc1cc(C)c(CCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCc2oc(CCC)c(C)c2C)COP(=O)(O)OCCN)o1
InChIInChI=1S/C44H76NO10P/c1-6-24-38-32-35(3)40(53-38)26-20-16-12-8-11-15-19-23-29-44(47)54-39(34-52-56(48,49)51-31-30-45)33-50-43(46)28-22-18-14-10-9-13-17-21-27-42-37(5)36(4)41(55-42)25-7-2/h32,39H,6-31,33-34,45H2,1-5H3,(H,48,49)/t39-/m1/s1
InChIKeyYIPLQRMNKXZEQO-LDLOPFEMSA-N
ChEBI Ontology
Outgoing Relation(s)
PE(DiMe(11,3)/MonoMe(11,3)) (CHEBI:180044) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[11-(3,4-dimethyl-5-propyluran-2-yl)undecanoyloxy]propan-2-yl] 11-(3-methyl-5-propyluran-2-yl)undecanoate
Manual XrefsDatabases
59662756ChemSpider
HMDB0061476HMDB