CHEBI:140004 - oscr#23(1−)

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ChEBI Name oscr#23(1−)
ChEBI ID CHEBI:140004
ChEBI ASCII Name oscr#23(1-)
Definition A hydroxy fatty acid ascaroside anion that is the conjugate base of oscr#23, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Michael Witting
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Formula C20H35O6
Net Charge -1
Average Mass 371.489
Monoisotopic Mass 371.24391
InChI InChI=1S/C20H36O6/c1-16-17(21)15-18(22)20(26-16)25-14-12-10-8-6-4-2-3-5-7-9-11-13-19(23)24/h11,13,16-18,20-22H,2-10,12,14-15H2,1H3,(H,23,24)/p-1/b13-11+/t16-,17+,18+,20+/m0/s1
InChIKey DIYWZICECWKTIT-XKCSVMQCSA-M
SMILES [C@@H]1([C@@H](C[C@H]([C@@H](O1)C)O)O)OCCCCCCCCCCC/C=C/C([O-])=O
ChEBI Ontology
Outgoing oscr#23(1−) (CHEBI:140004) is a hydroxy fatty acid ascaroside anion (CHEBI:140307)
oscr#23(1−) (CHEBI:140004) is conjugate base of oscr#23 (CHEBI:79145)
Incoming oscr#23 (CHEBI:79145) is conjugate acid of oscr#23(1−) (CHEBI:140004)
IUPAC Name
(2E)-14-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]tetradec-2-enoate
Last Modified
02 March 2018