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CHEBI:228146 - N-(1-deoxy-β-D-fructopyranos-1-yl)-L-valine betaine

ChEBI IDCHEBI:228146
ChEBI NameN-(1-deoxy-β-D-fructopyranos-1-yl)-L-valine betaine
Stars
ASCII NameN-(1-deoxy-beta-D-fructopyranos-1-yl)-L-valine betaine
DefinitionMajor species at pH 7.3
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC11H21NO7
Net Charge0
Average Mass279.289
Monoisotopic Mass279.13180
SMILESCC(C)[C@H]([NH2+]C[C@@]1(O)OC[C@@H](O)[C@@H](O)[C@@H]1O)C(=O)[O-]
InChIInChI=1S/C11H21NO7/c1-5(2)7(10(16)17)12-4-11(18)9(15)8(14)6(13)3-19-11/h5-9,12-15,18H,3-4H2,1-2H3,(H,16,17)/t6-,7+,8-,9+,11-/m1/s1
InChIKeyLXTJQOKOTMRERV-RKYHVTRTSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(1-deoxy-β-D-fructopyranos-1-yl)-L-valine betaine (CHEBI:228146) is a amino-acid betaine (CHEBI:22860)
UniProt Name  Source
N-(1-deoxy-β-D-fructopyranos-1-yl)-L-valineUniProt
Manual XrefsDatabases
CPD-25236MetaCyc