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CHEBI:139633 - ascr#16(1−)

ChEBI IDCHEBI:139633
ChEBI Nameascr#16(1−)
Stars
ASCII Nameascr#16(1-)
DefinitionA monocarboxylic acid anion that is conjugate base of ascr#16 resulting from the deprotonation of the carboxy group; Major species at pH 7.3.
Last Modified24 January 2024
SubmitterMichael Witting
DownloadsMolfile
FormulaC16H29O6
Net Charge-1
Average Mass317.402
Monoisotopic Mass317.19696
SMILESC[C@H](CCCCCCCC(=O)[O-])O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
InChIInChI=1S/C16H30O6/c1-11(8-6-4-3-5-7-9-15(19)20)21-16-14(18)10-13(17)12(2)22-16/h11-14,16-18H,3-10H2,1-2H3,(H,19,20)/p-1/t11-,12+,13-,14-,16-/m1/s1
InChIKeyUMKVAMCFIAMCAV-JTTNIQEDSA-M
ChEBI Ontology
Outgoing Relation(s)
ascr#16(1−) (CHEBI:139633) is a monocarboxylic acid anion (CHEBI:35757)
ascr#16(1−) (CHEBI:139633) is conjugate base of ascr#16 (CHEBI:78950)
Incoming Relation(s)
ascr#16 (CHEBI:78950) is conjugate acid of ascr#16(1−) (CHEBI:139633)
IUPAC Name 
(9R)-9-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]decanoate
Synonym  Source
ascr#16 anionChEBI