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CHEBI:140004 - oscr#23(1−)

ChEBI IDCHEBI:140004
ChEBI Nameoscr#23(1−)
Stars
ASCII Nameoscr#23(1-)
DefinitionA 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.
Last Modified2 March 2018
SubmitterMichael Witting
DownloadsMolfile
FormulaC20H35O6
Net Charge-1
Average Mass371.494
Monoisotopic Mass371.24391
SMILESC[C@@H]1O[C@@H](OCCCCCCCCCCC/C=C/C(=O)[O-])[C@H](O)C[C@H]1O
InChIInChI=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
InChIKeyDIYWZICECWKTIT-XKCSVMQCSA-M
ChEBI Ontology
Outgoing Relation(s)
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 Relation(s)
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