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ascr#30

Go to external page http://purl.obolibrary.org/obo/CHEBI_78968

An (omega-1)-hydroxy fatty acid ascaroside obtained by formal condensation of the alcoholic hydroxy group of (16R)-16-hydroxymargaric acid with ascarylopyranose (the alpha anomer). It is a metabolite of the nematode Caenorhabditis elegans.

Term info

Label

ascr#30

Synonyms
  • (16R)-16-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]heptadecanoic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
(16R)-16-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]heptadecanoic acid [ IUPAC ]

charge

0

formula

C23H44O6

has obo namespace

chebi_ontology

has related synonym

16R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-heptadecanoic acid

id

CHEBI:78968

inchi

InChI=1S/C23H44O6/c1-18(28-23-21(25)17-20(24)19(2)29-23)15-13-11-9-7-5-3-4-6-8-10-12-14-16-22(26)27/h18-21,23-25H,3-17H2,1-2H3,(H,26,27)/t18-,19+,20-,21-,23-/m1/s1

inchikey

XIVYAVYHUZLGIV-AIDNLNPPSA-N

mass

416.59190

monoisotopicmass

416.31379

smiles

C[C@H](CCCCCCCCCCCCCCC(O)=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O