CHEBI:79306 - glas#24

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name glas#24
ChEBI ID CHEBI:79306
Definition An ascarosyloxycarboxylic acid β-D-glucopyranosyl ester resulting from the formal esterification of the carboxy group of ascr#24 with the anomeric hydroxy group of β-D-glucopyranose. It is a metabolite of the nematode Caenorhabditis elegans.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ZINC000219962292
Download Molfile XML SDF
Formula C26H48O11
Net Charge 0
Average Mass 536.65270
Monoisotopic Mass 536.31966
InChI InChI=1S/C26H48O11/c1-16(34-25-19(29)14-18(28)17(2)35-25)12-10-8-6-4-3-5-7-9-11-13-21(30)37-26-24(33)23(32)22(31)20(15-27)36-26/h16-20,22-29,31-33H,3-15H2,1-2H3/t16-,17+,18-,19-,20-,22-,23+,24-,25-,26+/m1/s1
InChIKey ZZMOUVIMWCRXAF-UXOPZYHUSA-N
SMILES C[C@H](CCCCCCCCCCCC(=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
Metabolite of Species Details
Caenorhabditis elegans (NCBI:txid6239) Detected in acox-1(ok2257) mutant worms. See: PubMed
Roles Classification
Biological Role(s): Caenorhabditis elegans metabolite
A nematode metabolite produced by Caenorhabditis elegans.
semiochemical
A molecular messenger released by an organism that affects the behaviour within or between species.
(via hydroxy fatty acid ascaroside )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing glas#24 (CHEBI:79306) has functional parent ascr#24 (CHEBI:78962)
glas#24 (CHEBI:79306) has role Caenorhabditis elegans metabolite (CHEBI:78804)
glas#24 (CHEBI:79306) is a (ω−1)-hydroxy fatty acid ascaroside (CHEBI:79205)
glas#24 (CHEBI:79306) is a ascarosyloxycarboxylic acid β-D-glucopyranosyl ester (CHEBI:79198)
IUPAC Name
1-O-{(13R)-13-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]tetradecanoyl}-β-D-glucopyranose
Synonym Source
β-D-glucos-1''-yl-13R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-tetradecanoate SMID
Manual Xref Database
glas%2324 SMID
View more database links
Registry Numbers Types Sources
1355683-63-4 CAS Registry Number SMID
22233533 Reaxys Registry Number Reaxys
Citation Waiting for Citations
Last Modified
25 July 2014