NICOTINAMIDE-BETA-RIBOSIDE

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Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key JLEBZPBDRKPWTD-UHFFFAOYSA-O
Smiles NC(=O)c1ccc[n+](c1)C2OC(CO)C(O)C2O
InChI
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

Physicochemical Descriptors

Property Name Value
Molecular Formula C11H15N2O5
Molecular Weight 255.1
AlogP -1.53
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 3.0
Polar Surface Area 117.88
Heavy Atoms 18.0

Cross References

Resources Reference
CAS NUMBER 1341-23-7
NORMAN SUSDAT
CONTENTS