MiMeDB: Showing metabocard for Methyl beta-D-glucopyranoside (MMDBc0000819)

Record Information

Version

1.0

Status

Detected and Quantified

Creation Date

2020-12-10 22:03:44 UTC

Update Date

2024-10-11 03:09:32 UTC

Metabolite ID

MMDBc0000819

Metabolite Identification

Common Name

Methyl beta-D-glucopyranoside

Description

Methyl beta-D-glucopyranoside is found in cereals and cereal products. Methyl beta-D-glucopyranoside is present in Medicago sativa (alfalfa

Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
1-O-Methyl-beta-D-glucopyranoside	ChEBI
beta-D-Methylglucopyranoside	ChEBI
Beta-Methyl-D-glucoside	ChEBI
beta-Methylglucoside	ChEBI
Methyl beta-D-glucoside	ChEBI
Methyl hexopyranoside	ChEBI
1-O-Methyl-b-D-glucopyranoside	Generator
1-O-Methyl-β-D-glucopyranoside	Generator
b-D-Methylglucopyranoside	Generator
Β-D-methylglucopyranoside	Generator
b-Methyl-D-glucoside	Generator
Β-methyl-D-glucoside	Generator
b-Methylglucoside	Generator
Β-methylglucoside	Generator
Methyl b-D-glucoside	Generator
Methyl β-D-glucoside	Generator
Methyl b-D-glucopyranoside	Generator
Methyl β-D-glucopyranoside	Generator
Methyl D-glucopyranoside	HMDB
Methyl D-glucoside	HMDB
Methylglucoside	HMDB
Methylglucoside, (beta-D)-isomer	HMDB
1-O-Methylglucose	HMDB
D-Glucoside, methyl	HMDB
Methyl glucose	HMDB
Methyl-D-glucoside	HMDB

Molecular Formula

C₇H₁₄O₆

Average Mass

194.1825

Monoisotopic Mass

194.07903818

IUPAC Name

Not Available

Traditional Name

Not Available

CAS Registry Number

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4-,5+,6-,7-/m1/s1

InChI Key

HOVAGTYPODGVJG-XUUWZHRGSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as o-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond.

Kingdom

Organic compounds

Super Class

Organic oxygen compounds

Class

Organooxygen compounds

Sub Class

Carbohydrates and carbohydrate conjugates

Direct Parent

O-glycosyl compounds

Alternative Parents

Substituents

O-glycosyl compound
Oxane
Monosaccharide
Secondary alcohol
Oxacycle
Organoheterocyclic compound
Polyol
Acetal
Hydrocarbon derivative
Primary alcohol
Alcohol
Aliphatic heteromonocyclic compound

Molecular Framework

Aliphatic heteromonocyclic compounds

External Descriptors

beta-D-glucoside (CHEBI:320055 )
methyl D-glucoside (CHEBI:320055 )

Functional Ontology

Not Available

Physical Properties

State

Expected Solid

Predicted Properties

Not Available

Spectra

Not Available

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Feces

Tissue Locations

Not Available

Associated OMIM IDs

114500 (Colorectal cancer)
610247 (Eosinophilic esophagitis)

Human Proteins and Enzymes

Protein ID	Protein Name	Protein Type	Uniprot ID	Species
MMDBp0193626	Mannose-binding protein C	Unknown	P11226	Homo sapiens

Human Pathways

Pathways

Name	SMPDB/PathBank

Metabolic Reactions

Not Available

Health Effects and Bioactivity

Health Outcome/Bioactivity	Metabolite Response/Effect	Evidence Type	Host and Biospecimen	Data Source	Reference

Microbial Sources

Superkingdom/Kingdom	Phylum	Total species	Hosts and Body Sites	Microbial Links
Bacteria	Bacteroidetes	1	Human stool; Human ; Human gastric fluid; Human urine; Human feces	Indirect association between microbiota composition and metabolites measured in host biospecimen
Bacteria	Firmicutes	2	Human stool; Human feces	Indirect association between microbiota composition and metabolites measured in host biospecimen

Exposure Sources

Source Type	Activity	Data Source	Reference
Drugs	Antimicrobial	U.S. Environmental Protection Agency	CompTox
Cosmetics	Not Available	U.S. Environmental Protection Agency	CompTox
Domestics	Not Available	U.S. Environmental Protection Agency	CompTox
Domestics	Not Available	U.S. Environmental Protection Agency	CompTox

Host Biospecimen and Location

Host and Biospecimen	Status	Mean	Std	Min	Max	Units	Age	Sex	Health Condition	Data Source	Reference
Human Feces	Detected but not Quantified						Adult (>18 years old)	Both	Normal	HMDB	29808030

External Links

HMDB ID

HMDB0029965

DrugBank ID

DB01642

Phenol Explorer Compound ID

Not Available

FooDB ID

Not Available

KNApSAcK ID

Not Available

Chemspider ID

392933

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

445238

PDB ID

Not Available

ChEBI ID

320055

Food Biomarker Ontology

Not Available

References

Synthesis Reference

Not Available

General References

Yannai, Shmuel (2004). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. Boca Raton: Chapman & Hall/CRC..

Showing metabocard for Methyl beta-D-glucopyranoside (MMDBc0000819)

MOL for #<Metabolite:0x0000556b69ea0e50>

3D MOL for #<Metabolite:0x0000556b69ea0e50>

3D SDF for #<Metabolite:0x0000556b69ea0e50>

3D-SDF for #<Metabolite:0x0000556b69ea0e50>

PDB for #<Metabolite:0x0000556b69ea0e50>

3D PDB for #<Metabolite:0x0000556b69ea0e50>

SMILES for #<Metabolite:0x0000556b69ea0e50>

INCHI for #<Metabolite:0x0000556b69ea0e50>

Structure for #<Metabolite:0x0000556b69ea0e50>

3D Structure for #<Metabolite:0x0000556b69ea0e50>