CHEBI:134458 - cyclodopa 5-β-D-glucoside

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name cyclodopa 5-β-D-glucoside
ChEBI ID CHEBI:134458
ChEBI ASCII Name cyclodopa 5-beta-D-glucoside
Definition An indolyl carbohydrate that is cyclodopa in which the phenolic hydrogen at position 5 has been replaced by a β-D-glucosyl residue.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:81316
Supplier Information
Download Molfile XML SDF
Formula C15H19NO9
Net Charge 0
Average Mass 357.313
Monoisotopic Mass 357.10598
InChI InChI=1S/C15H19NO9/c17-4-10-11(19)12(20)13(21)15(25-10)24-9-2-5-1-7(14(22)23)16-6(5)3-8(9)18/h2-3,7,10-13,15-21H,1,4H2,(H,22,23)/t7-,10+,11+,12-,13+,15+/m0/s1
InChIKey PXMFPPFHRQZIHO-OLCQZNMOSA-N
SMILES N1C2=CC(O)=C(O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)CO)C=C2C[C@H]1C(=O)O
Metabolite of Species Details
Mus musculus (NCBI:txid10090) See: MetaboLights Study
Rattus norvegicus (NCBI:txid10116) See: MetaboLights Study
Beta vulgaris (NCBI:txid161934) Found in root (BTO:0001188). See: PubMed
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
rat metabolite
Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cyclodopa 5-β-D-glucoside (CHEBI:134458) has functional parent leucodopachrome (CHEBI:60872)
cyclodopa 5-β-D-glucoside (CHEBI:134458) has role mouse metabolite (CHEBI:75771)
cyclodopa 5-β-D-glucoside (CHEBI:134458) has role plant metabolite (CHEBI:76924)
cyclodopa 5-β-D-glucoside (CHEBI:134458) has role rat metabolite (CHEBI:86264)
cyclodopa 5-β-D-glucoside (CHEBI:134458) is a β-D-glucoside (CHEBI:22798)
cyclodopa 5-β-D-glucoside (CHEBI:134458) is a indolyl carbohydrate (CHEBI:24821)
cyclodopa 5-β-D-glucoside (CHEBI:134458) is a indolyl carboxylic acid (CHEBI:46867)
cyclodopa 5-β-D-glucoside (CHEBI:134458) is a phenols (CHEBI:33853)
IUPAC Name
(2S)-5-(β-D-glucopyranosyloxy)-6-hydroxy-2,3-dihydro-1H-indole-2-carboxylic acid
Synonyms Sources
cyclo-Dopa 5-O-glucoside KEGG COMPOUND
Cyclodopa glucoside HMDB
leucodopachrome 5-β-D-glucoside ChEBI
leucodopachrome glucoside ChEBI
Manual Xrefs Databases
C17751 KEGG COMPOUND
CPD-8656 MetaCyc
HMDB0029833 HMDB
View more database links
Registry Numbers Types Sources
6985675 Reaxys Registry Number Reaxys
71242-23-4 CAS Registry Number HMDB
Citation Waiting for Citations Type Source
11421447 PubMed citation Europe PMC
Last Modified
17 August 2017