Terminology Service for NFDI4Health

1-O-hexadecyl-2-(8-carboxyoctanoyl)-sn-glycero-3-phosphocholine(1-)

Go to external page http://purl.obolibrary.org/obo/CHEBI_138269


An anionic phospholipid obtained by deprotonation of the free carboxy group of 1-O-hexadecyl-2-(8-carboxyoctanoyl)-sn-glycero-3-phosphocholine; major species at pH 7.3.

Term info

Label

1-O-hexadecyl-2-(8-carboxyoctanoyl)-sn-glycero-3-phosphocholine(1-)

Synonyms
  • (9R)-9-[(hexadecyloxy)methyl]-2,2-dimethyl-6-oxido-6,11-dioxo-5,7,10-trioxa-2-azonia-6lambda(5)-phosphanonadecan-19-oate
database cross reference
Subsets

3_STAR

IUPAC NAME
(9R)-9-[(hexadecyloxy)methyl]-2,2-dimethyl-6-oxido-6,11-dioxo-5,7,10-trioxa-2-azonia-6lambda(5)-phosphanonadecan-19-oate [ IUPAC ]

charge

-1

formula

C33H65NO9P

has obo namespace

chebi_ontology

has related synonym

Azelaoyl-PAF(1-), PC(O-16:0/9:0(COOH))(1-), 1-O-hexadecyl-2-nonadioyl-sn-glycero-3-phosphocholine, 1-O-hexadecyl-2-azelaoyl-sn-glycero-3-phosphocholine(1-)

id

CHEBI:138269

inchi

InChI=1S/C33H66NO9P/c1-5-6-7-8-9-10-11-12-13-14-15-16-20-23-27-40-29-31(30-42-44(38,39)41-28-26-34(2,3)4)43-33(37)25-22-19-17-18-21-24-32(35)36/h31H,5-30H2,1-4H3,(H-,35,36,38,39)/p-1/t31-/m1/s1

inchikey

ZDFOCDTXDPKJKA-WJOKGBTCSA-M

mass

650.846

monoisotopicmass

650.44024

smiles

C(=O)(CCCCCCCC([O-])=O)O[C@@H](COP(=O)(OCC[N+](C)(C)C)[O-])COCCCCCCCCCCCCCCCC