Terminology Service for NFDI4Health

N-eicosanoylsphingosine 1-phosphate(2-)

Go to external page http://purl.obolibrary.org/obo/CHEBI_72967


A ceramide 1-phosphate(2-) in which the N-acyl group is specified as eicosanoyl.

Term info

Label

N-eicosanoylsphingosine 1-phosphate(2-)

Synonyms
  • (2S,3R,4E)-3-hydroxy-2-(icosanoylamino)octadec-4-en-1-yl phosphate
Subsets

3_STAR

IUPAC NAME
(2S,3R,4E)-3-hydroxy-2-(icosanoylamino)octadec-4-en-1-yl phosphate [ IUPAC ]

charge

-2

formula

C38H74NO6P

has obo namespace

chebi_ontology

has related synonym

CerP(d18:1/20:0), N-eicosanoylsphing-4-enine-1-phosphate, N-icosanoylsphing-4-enine-1-phosphate(2-), N-(eicosanoyl)sphing-4-enine-1-phosphate, N-icosanoylsphingosine 1-phosphate(2-)

id

CHEBI:72967

inchi

InChI=1S/C38H76NO6P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-38(41)39-36(35-45-46(42,43)44)37(40)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h31,33,36-37,40H,3-30,32,34-35H2,1-2H3,(H,39,41)(H2,42,43,44)/p-2/b33-31+/t36-,37+/m0/s1

inchikey

QDXTYNOQCQVNET-NUKVNZTCSA-L

mass

671.97100

monoisotopicmass

671.52647

smiles

CCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](COP([O-])([O-])=O)[C@H](O)\C=C\CCCCCCCCCCCCC