Terminology Service for NFDI4Health

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

Go to external page http://purl.obolibrary.org/obo/CHEBI_131660


A 1,2-diacyl-sn-glycero-3-phosphocholine in which the acyl groups at positions 1 and 2 are specified as heptadecanoyl and (9Z,12Z,15Z)-octadecatrienoyl respectively.

Term info

Label

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

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

3_STAR

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

charge

0

formula

C43H80NO8P

has obo namespace

chebi_ontology

has related synonym

1-heptadecanoyl-2-(alpha-linolenoyl)-sn-glycero-3-phosphocholine, phosphatidylcholine (17:0/18:3(9Z,12Z,15Z)), PC(17:0/18:3), 1-heptadecanoyl-2-linolenoyl-sn-glycero-3-phosphocholine, PC(17:0/18:3(9Z,12Z,15Z)), phosphatidylcholine (17:0/18:3), 1-heptadecanoyl-2-(9Z,12Z,15Z-octadecatrienoyl)-glycero-3-phosphocholine

id

CHEBI:131660

inchi

InChI=1S/C43H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44(3,4)5)39-49-42(45)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,41H,6-7,9,11-13,15,17-19,21,23-40H2,1-5H3/b10-8-,16-14-,22-20-/t41-/m1/s1

inchikey

JWRXJXZFMNQZBD-CAPSFDDTSA-N

mass

770.073

monoisotopicmass

769.56216

smiles

C(C[N+](C)(C)C)OP(=O)([O-])OC[C@H](OC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O)COC(CCCCCCCCCCCCCCCC)=O