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1-docosanoyl-2-eicosanoyl-sn-glycero-3-phosphocholine

Go to external page http://purl.obolibrary.org/obo/CHEBI_86210

A phosphatidylcholine 42:0 in which the acyl groups specified at positions 1 and 2 are docosanoyl and eicosanoyl respectively.

Term info

Label

1-docosanoyl-2-eicosanoyl-sn-glycero-3-phosphocholine

Synonyms
  • (2R)-3-(docosanoyloxy)-2-(icosanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
database cross reference
Subsets

3_STAR

IUPAC NAME
(2R)-3-(docosanoyloxy)-2-(icosanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate [ IUPAC ]

charge

0

formula

C50H100NO8P

has obo namespace

chebi_ontology

has related synonym

1-Behenoyl-2-arachidonyl-sn-glycero-3-phosphocholine, Phosphatidylcholine(22:0/20:0), GPCho(22:0/20:0), PC(22:0/20:0)

id

CHEBI:86210

inchi

InChI=1S/C50H100NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-27-28-30-32-34-36-38-40-42-49(52)56-46-48(47-58-60(54,55)57-45-44-51(3,4)5)59-50(53)43-41-39-37-35-33-31-29-26-23-21-19-17-15-13-11-9-7-2/h48H,6-47H2,1-5H3/t48-/m1/s1

inchikey

BBKWJNNMTSKJKD-QSCHNALKSA-N

mass

874.30470

monoisotopicmass

873.71866

smiles

CCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCC