CHEBI:140055 - oscr#7(1−)

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ChEBI Name oscr#7(1−)
ChEBI ID CHEBI:140055
ChEBI ASCII Name oscr#7(1-)
Definition A hydroxy fatty acid ascaroside anion resulting from the deprotonation of the carboxy group of oscr#7. The conjugate base of oscr#7 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 C13H21O6
Net Charge -1
Average Mass 273.303
Monoisotopic Mass 273.13436
InChI InChI=1S/C13H22O6/c1-9-10(14)8-11(15)13(19-9)18-7-5-3-2-4-6-12(16)17/h4,6,9-11,13-15H,2-3,5,7-8H2,1H3,(H,16,17)/p-1/b6-4+/t9-,10+,11+,13+/m0/s1
InChIKey PECXANWMSPKDGB-XROMHLQASA-M
SMILES [C@@H]1([C@@H](C[C@H]([C@@H](O1)C)O)O)OCCCC\C=C\C(=O)[O-]
ChEBI Ontology
Outgoing oscr#7(1−) (CHEBI:140055) is a hydroxy fatty acid ascaroside anion (CHEBI:140307)
oscr#7(1−) (CHEBI:140055) is conjugate base of oscr#7 (CHEBI:79132)
Incoming oscr#7 (CHEBI:79132) is conjugate acid of oscr#7(1−) (CHEBI:140055)
IUPAC Name
(2E)-7-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]hept-2-enoate
Last Modified
02 March 2018