CHEBI:79258 - bhos#16

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name bhos#16
ChEBI ID CHEBI:79258
Definition An ω-hydroxy fatty acid ascaroside that is oscr#16 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
Download Molfile XML SDF
Formula C16H30O7
Net Charge 0
Average Mass 334.40520
Monoisotopic Mass 334.19915
InChI InChI=1S/C16H30O7/c1-11-13(18)10-14(19)16(23-11)22-8-6-4-2-3-5-7-12(17)9-15(20)21/h11-14,16-19H,2-10H2,1H3,(H,20,21)/t11-,12+,13+,14+,16+/m0/s1
InChIKey ICHNWKCNPXYDRV-UTHRFFRBSA-N
SMILES C[C@@H]1O[C@@H](OCCCCCCC[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) 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#16 (CHEBI:79258) has functional parent (3R)-3,10-dihydroxydecanoic acid (CHEBI:79272)
bhos#16 (CHEBI:79258) has functional parent oscr#16 (CHEBI:79138)
bhos#16 (CHEBI:79258) has role Caenorhabditis elegans metabolite (CHEBI:78804)
bhos#16 (CHEBI:79258) is a ω-hydroxy fatty acid ascaroside (CHEBI:79204)
bhos#16 (CHEBI:79258) is a 3-hydroxy carboxylic acid (CHEBI:61355)
bhos#16 (CHEBI:79258) is a monocarboxylic acid (CHEBI:25384)
bhos#16 (CHEBI:79258) is conjugate acid of bhos#16(1-) (CHEBI:139785)
Incoming ibho#16 (CHEBI:79371) has functional parent bhos#16 (CHEBI:79258)
bhos#16(1-) (CHEBI:139785) is conjugate base of bhos#16 (CHEBI:79258)
IUPAC Name
(3R)-10-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]-3-hydroxydecanoic acid
Synonyms Sources
(3R)-10-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]-3-hydroxycapric acid ChEBI
3R-hydroxy-10-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-decanoic acid SMID
Manual Xref Database
bhos%2316%0D SMID
View more database links
Registry Numbers Types Sources
1355682-73-3 CAS Registry Number Beilstein
1355682-73-3 CAS Registry Number SMID
22233411 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22239548 PubMed citation Europe PMC
Last Modified
25 July 2014