CHEBI:79266 - bhos#32

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ChEBI Name bhos#32
ChEBI ID CHEBI:79266
Definition An ω-hydroxy fatty acid ascaroside that is oscr#32 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 C24H46O7
Net Charge 0
Average Mass 446.61780
Monoisotopic Mass 446.32435
InChI InChI=1S/C24H46O7/c1-19-21(26)18-22(27)24(31-19)30-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-20(25)17-23(28)29/h19-22,24-27H,2-18H2,1H3,(H,28,29)/t19-,20+,21+,22+,24+/m0/s1
InChIKey PLOMOPYTWRTKLB-YWCCWUOUSA-N
SMILES C[C@@H]1O[C@@H](OCCCCCCCCCCCCCCC[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#32 (CHEBI:79266) has functional parent (3R)-3,18-dihydroxyoctadecanoic acid (CHEBI:79290)
bhos#32 (CHEBI:79266) has functional parent oscr#32 (CHEBI:79154)
bhos#32 (CHEBI:79266) has role Caenorhabditis elegans metabolite (CHEBI:78804)
bhos#32 (CHEBI:79266) is a ω-hydroxy fatty acid ascaroside (CHEBI:79204)
bhos#32 (CHEBI:79266) is a 3-hydroxy carboxylic acid (CHEBI:61355)
bhos#32 (CHEBI:79266) is a monocarboxylic acid (CHEBI:25384)
bhos#32 (CHEBI:79266) is conjugate acid of bhos#32(1-) (CHEBI:139811)
Incoming bhos#32(1-) (CHEBI:139811) is conjugate base of bhos#32 (CHEBI:79266)
IUPAC Name
(3R)-18-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]-3-hydroxyoctadecanoic acid
Synonyms Sources
(3R)-18-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]-3-hydroxystearic acid ChemIDplus
3R-hydroxy-18-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-octadecanoic acid SMID
3R-hydroxy-18-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-stearic acid ChEBI
Manual Xref Database
bhos%2332 SMID
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Registry Numbers Types Sources
1413439-62-9 CAS Registry Number SMID
22233500 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22239548 PubMed citation Europe PMC
Last Modified
25 July 2014