CHEBI:79267 - bhos#34

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ChEBI Name bhos#34
ChEBI ID CHEBI:79267
Definition An ω-hydroxy fatty acid ascaroside that is oscr#34 in which the pro-R hydrogen β to the carboxy group is replaced by a hydroxy group. 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 C25H48O7
Net Charge 0
Average Mass 460.64440
Monoisotopic Mass 460.34000
InChI InChI=1S/C25H48O7/c1-20-22(27)19-23(28)25(32-20)31-17-15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-21(26)18-24(29)30/h20-23,25-28H,2-19H2,1H3,(H,29,30)/t20-,21+,22+,23+,25+/m0/s1
InChIKey HRSIKXSIYLWWRZ-BKXWLNCVSA-N
SMILES C[C@@H]1O[C@@H](OCCCCCCCCCCCCCCCC[C@@H](O)CC(O)=O)[C@H](O)C[C@H]1O
Metabolite of Species Details
Caenorhabditis elegans (NCBI:txid6239) Detected in dhs-28(hj8), daf-22(ok693), and maoc-1(hj13) 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 bhos#34 (CHEBI:79267) has functional parent (3R)-3,19-dihydroxynonadecanoic acid (CHEBI:79291)
bhos#34 (CHEBI:79267) has functional parent oscr#34 (CHEBI:79156)
bhos#34 (CHEBI:79267) has role Caenorhabditis elegans metabolite (CHEBI:78804)
bhos#34 (CHEBI:79267) is a ω-hydroxy fatty acid ascaroside (CHEBI:79204)
bhos#34 (CHEBI:79267) is a 3-hydroxy carboxylic acid (CHEBI:61355)
bhos#34 (CHEBI:79267) is a monocarboxylic acid (CHEBI:25384)
bhos#34 (CHEBI:79267) is conjugate acid of bhos#34(1-) (CHEBI:139814)
Incoming bhos#34(1-) (CHEBI:139814) is conjugate base of bhos#34 (CHEBI:79267)
IUPAC Name
(3R)-19-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]-3-hydroxynonadecanoic acid
Synonym Source
3R-hydroxy-19-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-nonadecanoic acid SMID
Manual Xref Database
bhos%2334 SMID
View more database links
Registry Numbers Types Sources
1355682-87-9 CAS Registry Number SMID
22233512 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22239548 PubMed citation Europe PMC
Last Modified
25 July 2014