Terminology Service for NFDI4Health

1-eicosanoyl-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine

Go to external page http://purl.obolibrary.org/obo/CHEBI_86171


A phosphatidylcholine 38:1 in which the acyl groups at positions 1 and 2 are eicosanoyl and (9Z)-octadecenoyl respectively.

Term info

Label

1-eicosanoyl-2-[(9Z)-octadecenoyl]-sn-glycero-3-phosphocholine

Synonyms
  • (2R)-3-(icosanoyloxy)-2-{[(9Z)-octadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
database cross reference
Subsets

3_STAR

IUPAC NAME
(2R)-3-(icosanoyloxy)-2-{[(9Z)-octadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate [ IUPAC ]

charge

0

formula

C46H90NO8P

has obo namespace

chebi_ontology

has related synonym

PC(20:0/18:1w9), GPCho(20:0/18:1n9), Phosphatidylcholine(20:0/18:1n9), PC(20:0/18:1n9), GPCho(20:0/18:1w9), Phosphatidylcholine(20:0/18:1), GPCho(20:0/18:1), PC(20:0/18:1), Phosphatidylcholine(20:0/18:1w9), 1-Arachidonyl-2-oleoyl-sn-glycero-3-phosphocholine, PC(20:0/18:1(9Z))

id

CHEBI:86171

inchi

InChI=1S/C46H90NO8P/c1-6-8-10-12-14-16-18-20-22-23-25-26-28-30-32-34-36-38-45(48)52-42-44(43-54-56(50,51)53-41-40-47(3,4)5)55-46(49)39-37-35-33-31-29-27-24-21-19-17-15-13-11-9-7-2/h21,24,44H,6-20,22-23,25-43H2,1-5H3/b24-21-/t44-/m1/s1

inchikey

IKNYBQRADNMEDT-FHLWKLDVSA-N

mass

816.18250

monoisotopicmass

815.64041

smiles

CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCC\C=C/CCCCCCCC