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CHEBI:140058 - oscr#9(1−)

Default Structure
ChEBI IDCHEBI:140058
ChEBI Nameoscr#9(1−)
Stars
ASCII Nameoscr#9(1-)
DefinitionA hydroxy fatty acid ascaroside anion resulting from the deprotonation of the carboxy group of oscr#9. The conjugate base of oscr#9 and the major species at pH 7.3.
Last Modified2 March 2018
SubmitterMichael Witting
DownloadsMolfile
FormulaC11H19O6
Net Charge-1
Average Mass247.267
Monoisotopic Mass247.11871
SMILESC[C@@H]1O[C@@H](OCCCCC(=O)[O-])[C@H](O)C[C@H]1O
InChIInChI=1S/C11H20O6/c1-7-8(12)6-9(13)11(17-7)16-5-3-2-4-10(14)15/h7-9,11-13H,2-6H2,1H3,(H,14,15)/p-1/t7-,8+,9+,11+/m0/s1
InChIKeyRGLRYSHQCRBEIV-YSSBGUOXSA-M
ChEBI Ontology
Outgoing Relation(s)
oscr#9(1−) (CHEBI:140058) is a hydroxy fatty acid ascaroside anion (CHEBI:140307)
oscr#9(1−) (CHEBI:140058) is conjugate base of oscr#9 (CHEBI:79133)
Incoming Relation(s)
oscr#9 (CHEBI:79133) is conjugate acid of oscr#9(1−) (CHEBI:140058)
IUPAC Name 
5-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]pentanoate