CHEBI:79131 - oscr#3

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ChEBI Name oscr#3
ChEBI ID CHEBI:79131
Definition An ω-hydroxy fatty acid ascaroside obtained by formal condensation of the alcoholic hydroxy group of (2E)-9-hydroxynon-2-enoic acid with ascarylopyranose (the α anomer). 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 C15H26O6
Net Charge 0
Average Mass 302.36330
Monoisotopic Mass 302.17294
InChI InChI=1S/C15H26O6/c1-11-12(16)10-13(17)15(21-11)20-9-7-5-3-2-4-6-8-14(18)19/h6,8,11-13,15-17H,2-5,7,9-10H2,1H3,(H,18,19)/b8-6+/t11-,12+,13+,15+/m0/s1
InChIKey CYRZSEWKKCHVSI-XHDDSBKUSA-N
SMILES C[C@@H]1O[C@@H](OCCCCCC\C=C\C(O)=O)[C@H](O)C[C@H]1O
Metabolite of Species Details
Caenorhabditis elegans (NCBI:txid6239) Detected in maoc-1(hj13) and acox-1(ok2257) mutant worms. See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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 oscr#3 (CHEBI:79131) has functional parent (2E)-9-hydroxynon-2-enoic acid (CHEBI:79115)
oscr#3 (CHEBI:79131) has role Caenorhabditis elegans metabolite (CHEBI:78804)
oscr#3 (CHEBI:79131) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
oscr#3 (CHEBI:79131) is a ω-hydroxy fatty acid ascaroside (CHEBI:79204)
oscr#3 (CHEBI:79131) is conjugate acid of oscr#3(1−) (CHEBI:140025)
Incoming icos#3 (CHEBI:79114) has functional parent oscr#3 (CHEBI:79131)
oscr#3-CoA (CHEBI:140053) has functional parent oscr#3 (CHEBI:79131)
oscr#3(1−) (CHEBI:140025) is conjugate base of oscr#3 (CHEBI:79131)
IUPAC Name
(2E)-9-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]non-2-enoic acid
Synonym Source
9-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-2E-nonenoic acid SMID
Manual Xref Database
oscr%233 SMID
View more database links
Registry Numbers Types Sources
1355682-01-7 CAS Registry Number SMID
22233396 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22239548 PubMed citation Europe PMC
Last Modified
19 February 2018