CHEBI:228153 - N-(1-deoxy-β-D-fructopyranos-1-yl)-L-phenylalanine betaine

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name N-(1-deoxy-β-D-fructopyranos-1-yl)-L-phenylalanine betaine
ChEBI ID CHEBI:228153
ChEBI ASCII Name N-(1-deoxy-beta-D-fructopyranos-1-yl)-L-phenylalanine betaine
Definition Major species at pH 7.3
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C15H21NO7
Net Charge 0
Average Mass 327.333
Monoisotopic Mass 327.13180
InChI InChI=1S/C15H21NO7/c17-11-7-23-15(22,13(19)12(11)18)8-16-10(14(20)21)6-9-4-2-1-3-5-9/h1-5,10-13,16-19,22H,6-8H2,(H,20,21)/t10-,11+,12+,13-,15+/m0/s1
InChIKey CPXVOVGNKRERLG-IHWVXMPCSA-N
SMILES C1O[C@]([C@H]([C@@H]([C@@H]1O)O)O)(O)C[NH2+][C@H](C([O-])=O)CC=2C=CC=CC2
ChEBI Ontology
Outgoing N-(1-deoxy-β-D-fructopyranos-1-yl)-L-phenylalanine betaine (CHEBI:228153) is a amino-acid betaine (CHEBI:22860)
Synonym Source
N-(1-deoxy-β-D-fructopyranos-1-yl)-L-phenylalanine UniProt