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CHEBI:140055 - oscr#7(1−)

ChEBI IDCHEBI:140055
ChEBI Nameoscr#7(1−)
Stars
ASCII Nameoscr#7(1-)
DefinitionA 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.
Last Modified2 March 2018
SubmitterMichael Witting
DownloadsMolfile
FormulaC13H21O6
Net Charge-1
Average Mass273.305
Monoisotopic Mass273.13436
SMILESC[C@@H]1O[C@@H](OCCCC/C=C/C(=O)[O-])[C@H](O)C[C@H]1O
InChIInChI=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
InChIKeyPECXANWMSPKDGB-XROMHLQASA-M
ChEBI Ontology
Outgoing Relation(s)
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 Relation(s)
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