CHEBI:140019 - oscr#28(1−)

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ChEBI Name oscr#28(1−)
ChEBI ID CHEBI:140019
ChEBI ASCII Name oscr#28(1-)
Definition A hydroxy fatty acid ascaroside anion that is the conjugate base of oscr#28, 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 C22H41O6
Net Charge -1
Average Mass 401.558
Monoisotopic Mass 401.29086
InChI InChI=1S/C22H42O6/c1-18-19(23)17-20(24)22(28-18)27-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-21(25)26/h18-20,22-24H,2-17H2,1H3,(H,25,26)/p-1/t18-,19+,20+,22+/m0/s1
InChIKey RARJQAOGTFMPFZ-GPQLQYNLSA-M
SMILES [C@@H]1([C@@H](C[C@H]([C@@H](O1)C)O)O)OCCCCCCCCCCCCCCCC([O-])=O
ChEBI Ontology
Outgoing oscr#28(1−) (CHEBI:140019) is a hydroxy fatty acid ascaroside anion (CHEBI:140307)
oscr#28(1−) (CHEBI:140019) is conjugate base of oscr#28 (CHEBI:79150)
Incoming oscr#28 (CHEBI:79150) is conjugate acid of oscr#28(1−) (CHEBI:140019)
IUPAC Name
16-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]hexadecanoate
Last Modified
02 March 2018