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CHEBI:140025 - oscr#3(1−)

ChEBI IDCHEBI:140025
ChEBI Nameoscr#3(1−)
Stars
ASCII Nameoscr#3(1-)
DefinitionA hydroxy fatty acid ascaroside anion resulting from the deprotonation of the carboxy group of oscr#3. The conjugate base of oscr#3 and the major species at pH 7.3.
Last Modified2 March 2018
SubmitterMichael Witting
DownloadsMolfile
FormulaC15H25O6
Net Charge-1
Average Mass301.359
Monoisotopic Mass301.16566
SMILESC[C@@H]1O[C@@H](OCCCCCC/C=C/C(=O)[O-])[C@H](O)C[C@H]1O
InChIInChI=1S/C15H26O6/c1-11-12(16)10-13(17)15(21-11)20-9-7-5-3-2-4-6-8-14(18)19/h6,8,11-13,15-17H,2-5,7,9-10H2,1H3,(H,18,19)/p-1/b8-6+/t11-,12+,13+,15+/m0/s1
InChIKeyCYRZSEWKKCHVSI-XHDDSBKUSA-M
ChEBI Ontology
Outgoing Relation(s)
oscr#3(1−) (CHEBI:140025) is a hydroxy fatty acid ascaroside anion (CHEBI:140307)
oscr#3(1−) (CHEBI:140025) is conjugate base of oscr#3 (CHEBI:79131)
Incoming Relation(s)
oscr#3 (CHEBI:79131) is conjugate acid of oscr#3(1−) (CHEBI:140025)
IUPAC Name 
(2E)-9-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]non-2-enoate