Terminology Service for NFDI4Health
JSON

oscr#36(1-)

Go to external page http://purl.obolibrary.org/obo/CHEBI_140044

A hydroxy fatty acid ascaroside anion that is the conjugate base of oscr#36, obtained by deprotonation of the carboxy group; major species at pH 7.3.

Term info

Label

oscr#36(1-)

Synonyms
  • 20-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]icosanoate
Subsets

3_STAR

IUPAC NAME
20-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]icosanoate [ IUPAC ]

charge

-1

formula

C26H49O6

has obo namespace

chebi_ontology

id

CHEBI:140044

inchi

InChI=1S/C26H50O6/c1-22-23(27)21-24(28)26(32-22)31-20-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19-25(29)30/h22-24,26-28H,2-21H2,1H3,(H,29,30)/p-1/t22-,23+,24+,26+/m0/s1

inchikey

NALXHMIWEUPQCH-POMLREGLSA-M

mass

457.665

monoisotopicmass

457.35346

smiles

[C@@H]1([C@@H](C[C@H]([C@@H](O1)C)O)O)OCCCCCCCCCCCCCCCCCCCC([O-])=O