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CHEBI:139978 - oscr#15(1−)

ChEBI IDCHEBI:139978
ChEBI Nameoscr#15(1−)
Stars
ASCII Nameoscr#15(1-)
DefinitionA hydroxy fatty acid ascaroside anion that is the conjugate base of oscr#15, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Last Modified2 March 2018
SubmitterMichael Witting
DownloadsMolfile
FormulaC16H27O6
Net Charge-1
Average Mass315.386
Monoisotopic Mass315.18131
SMILESC[C@@H]1O[C@@H](OCCCCCCC/C=C/C(=O)[O-])[C@H](O)C[C@H]1O
InChIInChI=1S/C16H28O6/c1-12-13(17)11-14(18)16(22-12)21-10-8-6-4-2-3-5-7-9-15(19)20/h7,9,12-14,16-18H,2-6,8,10-11H2,1H3,(H,19,20)/p-1/b9-7+/t12-,13+,14+,16+/m0/s1
InChIKeyLNUSDHULQVPZFO-RYJVCDSQSA-M
ChEBI Ontology
Outgoing Relation(s)
oscr#15(1−) (CHEBI:139978) is a hydroxy fatty acid ascaroside anion (CHEBI:140307)
oscr#15(1−) (CHEBI:139978) is conjugate base of oscr#15 (CHEBI:79137)
Incoming Relation(s)
oscr#15 (CHEBI:79137) is conjugate acid of oscr#15(1−) (CHEBI:139978)
IUPAC Name 
(2E)-10-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]dec-2-enoate