CHEBI:79307 - glas#26

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name glas#26
ChEBI ID CHEBI:79307
Definition An ascarosyloxycarboxylic acid β-D-glucopyranosyl ester resulting from the formal esterification of the carboxy group of ascr#26 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
Download Molfile XML SDF
Formula C27H50O11
Net Charge 0
Average Mass 550.67930
Monoisotopic Mass 550.33531
InChI InChI=1S/C27H50O11/c1-17(35-26-20(30)15-19(29)18(2)36-26)13-11-9-7-5-3-4-6-8-10-12-14-22(31)38-27-25(34)24(33)23(32)21(16-28)37-27/h17-21,23-30,32-34H,3-16H2,1-2H3/t17-,18+,19-,20-,21-,23-,24+,25-,26-,27+/m1/s1
InChIKey GSRDQXYUFNVAAO-SEYCSDJLSA-N
SMILES C[C@H](CCCCCCCCCCCCC(=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#26 (CHEBI:79307) has functional parent ascr#26 (CHEBI:78964)
glas#26 (CHEBI:79307) has role Caenorhabditis elegans metabolite (CHEBI:78804)
glas#26 (CHEBI:79307) is a (ω−1)-hydroxy fatty acid ascaroside (CHEBI:79205)
glas#26 (CHEBI:79307) is a ascarosyloxycarboxylic acid β-D-glucopyranosyl ester (CHEBI:79198)
IUPAC Name
1-O-{(14R)-14-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]pentadecanoyl}-β-D-glucopyranose
Synonym Source
β-D-glucos-1''-yl-14R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-pentadecanoate SMID
Manual Xref Database
glas%2326 SMID
View more database links
Registry Numbers Types Sources
1355683-65-6 CAS Registry Number SMID
22233536 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22239548 PubMed citation Europe PMC
Last Modified
25 July 2014