Terminology Service for NFDI4Health
13-(beta-D-glucosyloxy)docosanoate
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http://purl.obolibrary.org/obo/CHEBI_36487
A monocarboxylic acid anion that is the conjugate base of 13-(beta-D-glucosyloxy)docosanoic acid, arising from deprotonation of the carboxy group.
Term info
Label
13-(beta-D-glucosyloxy)docosanoate
Synonyms
- 13-(beta-D-glucopyranosyloxy)docosanoate
- 13-(beta-D-glucosyloxy)docosanoate
Subsets
3_STAR
charge
-1
formula
C28H53O8
has alternative id
CHEBI:11319, CHEBI:19149
has obo namespace
chebi_ontology
has related synonym
13-beta-D-Glucosyloxydocosanoate
id
CHEBI:36487
inchi
InChI=1S/C28H54O8/c1-2-3-4-5-9-12-15-18-22(35-28-27(34)26(33)25(32)23(21-29)36-28)19-16-13-10-7-6-8-11-14-17-20-24(30)31/h22-23,25-29,32-34H,2-21H2,1H3,(H,30,31)/p-1/t22?,23-,25-,26+,27-,28-/m1/s1
inchikey
MVSYTBQOJXSHFZ-SFOFOFCKSA-M
mass
517.71562
monoisotopicmass
517.37459
smiles
CCCCCCCCCC(CCCCCCCCCCCC([O-])=O)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Term relations
Subclass of:
- monocarboxylic acid anion
- has functional parent some behenate
- is conjugate base of some 13-(beta-D-glucosyloxy)docosanoic acid
Related from: