input word =
C00007256
Metabolite Information
Structural formula
Name
NAD
Nicotinamide adenine dinucleotide
Formula
C21H27N7O14P2
Mw
663.10912161
CAS RN
53-84-9
C_ID
C00007256 ,
InChIKey
BAWFJGJZGIEFAR-WJWPZZAENA-N
InChICode
InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/t10-,11-,13+,14-,15+,16+,20-,21-/m1/s1
SMILES
NC(=O)c1ccc[n+]([C@H]2O[C@@H](COP(=O)([O-])OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@@H](O)C3O)[C@@H](O)C2O)c1
Start Substs in Alk. Biosynthesis (Prediction)
L-Asp
L-Phe
Organism
Kingdom
Family
Species
Reference
Bacteria
Enterobacteriaceae
Escherichia coli
Ref.
Plantae
Araliaceae
Panax ginseng
Ref.
Plantae
Cruciferae
Arabidopsis thaliana
Ref.
Plantae
Fabaceae
Phaseolus vulgaris
Ref.
Plantae
Poaceae
Oryza sativa
Ref.
-
-
FOOD SAKE
Ref.
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