Terminology Service for NFDI4Health

1,2-dioleoyl-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion

Go to external page http://purl.obolibrary.org/obo/CHEBI_85680


A 1,2-diacyl-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion in which the phosphatidyl acyl groups are both specified as oleoyl (9Z-octadecenoyl); major species at pH 7.3.

Term info

Label

1,2-dioleoyl-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion

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

3_STAR

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

charge

0

formula

C43H82NO8P

has obo namespace

chebi_ontology

has related synonym

1,2-di-(9Z-octadecenoyl)-sn-glycero-3-phospho-N,N-dimethylethanolamine, 1,2-di-(9Z-octadecenoyl)-sn-glycero-3-phospho-N,N-dimethylethanolamine zwitterion

id

CHEBI:85680

inchi

InChI=1S/C43H82NO8P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-42(45)49-39-41(40-51-53(47,48)50-38-37-44(3)4)52-43(46)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h19-22,41H,5-18,23-40H2,1-4H3,(H,47,48)/b21-19-,22-20-/t41-/m1/s1

inchikey

XHPZRQBHFOVLEJ-UNUIOPIBSA-N

mass

772.08680

monoisotopicmass

771.57781

smiles

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