Details of the Drug Metabolized by Drug-Metabolizing Enzyme (DME)

General Information of Drug (ID: DR2489)
Drug Name
Melibiose
Synonyms
D-Gal-alpha(1->6)-D-glucose; D-Gal-alpha1->6D-Glucose; D-Melibiose; D-mellibiose; Gal-alpha(1,6)Glc; SCHEMBL2504901; alpha-D-Gal-(1->6)-D-Glc; melibiose; 585-99-9; 6-(alpha-D-galactosido)-D-glucose; 6-O-(alpha-D-Galactopyranosyl)-D-glucopyranose; 6-O-alpha-D-Galactopyranosyl-D-glucopyranose; CHEBI:28053; Epitope ID:140529; M0050; alpha-D-Galp-(1->6)-D-Glc; alpha-D-Galp-(1->6)-D-Glcp; alpha-D-galactopyranosyl-1-6-D-glucopyranose; alpha-D-galactosyl-(1->6)-D-glucose; bmse000233
Indication Discovery agent Investigative [1]
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 342.3 Topological Polar Surface Area 190
Heavy Atom Count 23 Rotatable Bond Count 4
Hydrogen Bond Donor Count 8 Hydrogen Bond Acceptor Count 11
Cross-matching ID
PubChem CID
440658
ChEBI ID
CHEBI:28053
CAS Number
585-99-9
Formula
C12H22O11
Canonical SMILES
C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)O)O)O)O)O)O)O)O
InChI
1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2/t3-,4-,5+,6-,7+,8+,9-,10-,11?,12+/m1/s1
InChIKey
DLRVVLDZNNYCBX-ABXHMFFYSA-N
The Metabolic Roadmap of This Drug
The Full List of Drug Metabolites (DM) of This Drug
DM Name DM ID PubChem ID Reaction DM Level REF
Unclear DM009999 N. A. Unclear 1 [3]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR005836 Melibiose Unclear Unclear melA [3]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
Alpha-galactosidase (melA) DME1719 Streptococcus thermophilus
A0A564RX90_STRTR
3.2.1.22
[2]
Alpha-galactosidase (melA) DME2081 Lactobacillus salivarius
A0A385XL22_9LACO
3.2.1.22
[3]
Alpha-galactosidase (melA) DME2077 Lactobacillus buchneri
A0A5P0VEV3_LACBU
3.2.1.22
[3]
Alpha-galactosidase (melA) DME2080 Lactobacillus fermentum
Q6IYF5_LACFE
3.2.1.22
[3]
Alpha-galactosidase (melA) DME2082 Lactobacillus brevis
A0A378HFS0_LACBR
3.2.1.22
[3]
Beta-fructofuranosidase (BFRU) DME1711 Lactobacillus buchneri
A0A089QDN8_9LACO
3.2.1.26
[3]
Beta-fructofuranosidase (BFRU) DME1712 Lactobacillus fermentum
A0A089QDN8_9LACO
3.2.1.26
[3]
Beta-fructofuranosidase (BFRU) DME1713 Lactobacillus salivarius
A0A089QDN8_9LACO
3.2.1.26
[3]
⏷ Show the Full List of 8  DME(s)
References
1 Melibiose, a nondigestible disaccharide, promotes absorption of quercetin glycosides in rat small intestine. J Agric Food Chem. 2016 Dec 14;64(49):9335-9341.
2 Use of an alpha-galactosidase gene as a food-grade selection marker for Streptococcus thermophilus. J Dairy Sci. 2005 Jul;88(7):2341-7.
3 Alpha-glactosidase activity of lactobacilli. Appl Microbiol. 1973 Nov;26(5):783-8.

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