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1-[(9Z)-octadecenoyl]-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine

Go to external page http://purl.obolibrary.org/obo/CHEBI_86133

A phosphatidylcholine 36:4 in which the acyl groups specified at positions 1 and 2 are (9Z)-octadecenoyl and (9Z,12Z,15Z)-octadecatrienoyl respectively.

Term info

Label

1-[(9Z)-octadecenoyl]-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine

Synonyms
  • (2R)-2-{[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy}-3-{[(9Z)-octadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate
database cross reference
Subsets

3_STAR

IUPAC NAME
(2R)-2-{[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy}-3-{[(9Z)-octadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate [ IUPAC ]

charge

0

formula

C44H80NO8P

has obo namespace

chebi_ontology

has related synonym

PC(18:1w9/18:3w3), Phosphatidylcholine(18:1/18:3), Phosphatidylcholine(18:1w9/18:3w3), GPCho(18:1/18:3), Phosphatidylcholine(18:1n9/18:3n3), PC(18:1/18:3), 1-(9Z-octadecaenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphocholine, PC(18:1n9/18:3n3), 1-Oleoyl-2-alpha-linolenoyl-sn-glycero-3-phosphocholine, GPCho(18:1w9/18:3w3), GPCho(18:1n9/18:3n3), PC(18:1(9Z)/18:3(9Z,12Z,15Z))

id

CHEBI:86133

inchi

InChI=1S/C44H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h9,11,15,17,20-23,42H,6-8,10,12-14,16,18-19,24-41H2,1-5H3/b11-9-,17-15-,22-20-,23-21-/t42-/m1/s1

inchikey

FVQGNFUBHWGFCY-HJOYQDMMSA-N

mass

782.08170

monoisotopicmass

781.56216

smiles

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