CHEBI:139633 - ascr#16(1−)

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ChEBI Name ascr#16(1−)
ChEBI ID CHEBI:139633
ChEBI ASCII Name ascr#16(1-)
Definition A monocarboxylic acid anion that is conjugate base of ascr#16 resulting from the deprotonation of the carboxy group; 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 C16H29O6
Net Charge -1
Average Mass 317.403
Monoisotopic Mass 317.19696
InChI InChI=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
InChIKey UMKVAMCFIAMCAV-JTTNIQEDSA-M
SMILES C[C@H](CCCCCCCC([O-])=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O
ChEBI Ontology
Outgoing 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 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 anion ChEBI
Last Modified
24 January 2024