Nadide (BioDeep_00000003343)

 

Secondary id: BioDeep_00001868348

natural product PANOMIX_OTCML-2023 PANOMIX_OTCML-2025


Metabolite Card


beta-Nicotinamide adenine dinucleotide hydrate

  Formula: C21H27N7O14P2 (663.1091)
Chinese Names: 烟酰胺腺嘌呤二核苷酸
  Spectrum Hits: Top Source Homo sapiens(otcml) 6.57%

Reviewed

Last reviewed on 2025-06-24.

Cite this Page

Nadide. BioDeep Database v3. PANOMIX ltd, a top metabolomics service provider from China. https://query.biodeep.cn/s/nadide (retrieved 2025-11-16) (BioDeep RN: BioDeep_00000003343). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Molecular Structure

SMILES: C1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N
InChI: 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)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1


Description

[Spectral] NAD+ (exact mass = 663.10912) and 3,4-Dihydroxy-L-phenylalanine (exact mass = 197.06881) and Cytidine (exact mass = 243.08552) were not completely separated on HPLC under the present analytical conditions as described in AC$XXX. Additionally some of the peaks in this data contains dimers and other unidentified ions.
[Spectral] NAD+ (exact mass = 663.10912) and NADP+ (exact mass = 743.07545) were not completely separated on HPLC under the present analytical conditions as described in AC$XXX. Additionally some of the peaks in this data contains dimers and other unidentified ions.
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Synonyms

46 synonym names

beta-Nicotinamide adenine dinucleotide hydrate; Nicotinamide adenine dinucleotide; NICOTINAMIDE-adenine-dinucleotide; Nadide; NAD+; DPN; NAD; β-Nicotinamide adenine dinucleotide (NAD); TXE; NAD+; [[(2~{R},3~{S},4~{R},5~{R})-5-(3-aminocarbonylpyridin-1-ium-1-yl)-4-[[5-[4-cyano-2-[(~{E})-hydroxyiminomethyl]phenoxy]-1-oxidanyl-3~{H}-2,1$l^{4}-benzoxaborol-1-yl]oxy]-3-oxidanyl-oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate; [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate; [[(2R,3S,4R,5R)-5-[(3R)-3-aminocarbonyl-3,4-dihydro-2H-pyridin-1-yl]-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanidyl-ph osphoryl] [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl phosphate; 1-[(2R,3R,4S,5R)-5-{[({[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy(hydroxy)phosphoryl}oxy(hydroxy)phosphoryl)oxy]methyl}-3,4-dihydroxyoxolan-2-yl]-3-carbamoyl-1??-pyridin-1-ylium; 9JM; Adenine Dinucleotide, Dihydronicotinamide; Adenosine 5'-(trihydrogen diphosphate), P'-5'-ester with 3-(aminocarbonyl)-1-beta-D-ribofuranosylpyridinium, inner salt; adenosine 5'-{3-[1-(3-carbamoylpyridinio)-1,4-anhydro-D-ribitol-5-yl] dihydrogen diphosphate}; beta-nicotinamide adenine dinucleotide; BPBio1_000796; Coenzyme I; Dihydronicotinamide Adenine Dinucleotide; Dinucleotide, Dihydronicotinamide Adenine; Dinucleotide, Nicotinamide-Adenine; Diphosphopyridine Nucleotide; DivK1c_000189; IDI1_000189; KBio1_000189; KBio2_001453; KBio2_004021; KBio2_006589; KBio3_001561; NAD cation; NAD(+); NADH; Nadide (JAN/USAN/INN); Nadide [USAN:BAN:INN:JAN]; NAJ; Nicotinamide adenine dinucleotide (NAD+); Nicotinamide-Adenine Dinucleotide; Nucleotide, Diphosphopyridine; Prestwick3_000741; Spectrum2_001056; Spectrum3_000511; Spectrum4_000065; Spectrum5_001291



Cross Reference

36 cross reference id

Classification Terms

Related Pathways

Reactome(8)

BioCyc(47)

PlantCyc()

Biological Process

93815 related biological process reactions.

Reactome(369)

BioCyc(135)

WikiPathways(2)

Plant Reactome(2318)

INOH(58)

PlantCyc()

COVID-19 Disease Map(1)

PathBank(90932)