CHEBI:79197 - glas#1

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ChEBI Name glas#1
ChEBI ID CHEBI:79197
Definition An ascarosyloxycarboxylic acid β-D-glucopyranosyl ester resulting from the formal esterification of the carboxy group of ascr#1 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
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Formula C19H34O11
Net Charge 0
Average Mass 438.46670
Monoisotopic Mass 438.21011
InChI InChI=1S/C19H34O11/c1-9(27-18-12(22)7-11(21)10(2)28-18)5-3-4-6-14(23)30-19-17(26)16(25)15(24)13(8-20)29-19/h9-13,15-22,24-26H,3-8H2,1-2H3/t9-,10+,11-,12-,13-,15-,16+,17-,18-,19+/m1/s1
InChIKey MVQVASRYTUDSCI-POLQEPQQSA-N
SMILES C[C@H](CCCCC(=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#1 (CHEBI:79197) has functional parent ascr#1 (CHEBI:78786)
glas#1 (CHEBI:79197) has role Caenorhabditis elegans metabolite (CHEBI:78804)
glas#1 (CHEBI:79197) is a (ω−1)-hydroxy fatty acid ascaroside (CHEBI:79205)
glas#1 (CHEBI:79197) is a ascarosyloxycarboxylic acid β-D-glucopyranosyl ester (CHEBI:79198)
IUPAC Name
1-O-{(6R)-6-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]heptanoyl}-β-D-glucopyranose
Synonyms Sources
(6R)-6-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]heptanoic acid β-D-glucopyranos-1-yl ester ChEBI
(6R)-6-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]heptanoic acid β-D-glucopyranosyl ester ChEBI
ascr#1 β-D-glucopyranos-1-yl ester ChEBI
ascr#1 β-D-glucopyranosyl ester ChEBI
β-D-glucopyranos-1-yl (6R)-6-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]heptanoate ChEBI
β-D-glucopyranosyl (6R)-6-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]heptanoate ChEBI
β-D-glucos-1''-yl-6R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-heptanoate SMID
Manual Xref Database
glas%231 SMID
View more database links
Registry Number Type Source
22233476 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22239548 PubMed citation Europe PMC
Last Modified
25 July 2014