CHEBI:140025 - oscr#3(1−)

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ChEBI Name oscr#3(1−)
ChEBI ID CHEBI:140025
ChEBI ASCII Name oscr#3(1-)
Definition A 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.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Michael Witting
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Formula C15H25O6
Net Charge -1
Average Mass 301.356
Monoisotopic Mass 301.16566
InChI InChI=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
InChIKey CYRZSEWKKCHVSI-XHDDSBKUSA-M
SMILES [C@@H]1([C@@H](C[C@H]([C@@H](O1)C)O)O)OCCCCCC\C=C\C([O-])=O
ChEBI Ontology
Outgoing 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 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
Last Modified
02 March 2018