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

General Information of Drug (ID: DR1924)
Drug Name
SRT-647
Synonyms
N-ribosyl-nicotinamide; N-ribosylnicotinamide; SRT 647; SRT-647; SRT647; beta-nicotinamide D-riboside; nicotinamide ribonucleoside; nicotinamide ribose; nicotinamide riboside; nicotinamide-beta-riboside; ribosylnicotinamide; 0I8H2M0L7N; 1-(beta-D-Ribofuranosyl)nicotinamide; 1341-23-7; 3-Carbamoyl-1-((2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)pyridin-1-ium; 3-carbamoyl-1-beta-D-ribofuranosylpyridinium; AC1L98BO; CHEBI:15927; Pyridinium, 3-(aminocarbonyl)-1-beta-D-ribofuranosyl-; UNII-0I8H2M0L7N
Indication Mitochondrial myopathy [ICD11: 8C73] Phase 1 []
Structure
3D MOL 2D MOL
Pharmaceutical Properties Molecular Weight 255.25 Topological Polar Surface Area 117
Heavy Atom Count 18 Rotatable Bond Count 3
Hydrogen Bond Donor Count 4 Hydrogen Bond Acceptor Count 5
Cross-matching ID
PubChem CID
439924
ChEBI ID
CHEBI:15927
CAS Number
1341-23-7
TTD Drug ID
D0SI9L
Formula
C11H15N2O5+
Canonical SMILES
C1=CC(=C[N+](=C1)C2C(C(C(O2)CO)O)O)C(=O)N
InChI
1S/C11H14N2O5/c12-10(17)6-2-1-3-13(4-6)11-9(16)8(15)7(5-14)18-11/h1-4,7-9,11,14-16H,5H2,(H-,12,17)/p+1/t7-,8-,9-,11-/m1/s1
InChIKey
JLEBZPBDRKPWTD-TURQNECASA-O
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
Nicotinamide (NAM) DM003547
936
Hydrolysis - Hydrolysis 1 [1] , [2]
Nicotinic acid DM003548
938
Unclear 2 [2]
The Full List of Metabolic Reaction (MR) of This Drug
MR ID Reactant Product MR Type DME REF
MR003985 SRT-647 Nicotinamide (NAM) Hydrolysis - Hydrolysis PNP ... [1], [2]
MR003986 Nicotinamide (NAM) Nicotinic acid Unclear Unclear [2]
Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug
DME Name DME Info Species Uniprot ID EC Number REF
ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 2 (BST1) DMEN129 Homo sapiens
BST1_HUMAN
3.2.2.6
[1] , [2]
Purine nucleoside phosphorylase (PNP) DME0437 Homo sapiens
PNPH_HUMAN
2.4.2.1
[1] , [2]
Quinone reductase 2 (NQO2) DME0567 Homo sapiens
NQO2_HUMAN
1.10.5.1
[3]
References
1 Purine nucleoside phosphorylase controls nicotinamide riboside metabolism in mammalian cells
2 BST1 regulates nicotinamide riboside metabolism via its glycohydrolase and base-exchange activities
3 Insights into the redox cycle of human quinone reductase 2. Free Radic Res. 2011 Oct;45(10):1184-95.

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