This drug entry is a stub and has not been fully annotated. It is scheduled to be annotated soon.

Identification

Generic Name
Nadide
DrugBank Accession Number
DB14128
Background

A coenzyme composed of ribosylnicotinamide 5'-diphosphate coupled to adenosine 5'-phosphate by pyrophosphate linkage. It is found widely in nature and is involved in numerous enzymatic reactions in which it serves as an electron carrier by being alternately oxidized (NAD+) and reduced (NADH). (Dorland, 27th ed)

Type
Small Molecule
Groups
Experimental
Structure
Weight
Average: 663.4251
Monoisotopic: 663.109121631
Chemical Formula
C21H27N7O14P2
Synonyms
  • beta-Diphosphopyridine nucleotide
  • beta-NAD
  • beta-NAD+
  • beta-Nicotinamide adenine dinucleotide
  • Codehydrase I
  • Codehydrogenase I
  • Coenzyme I
  • Cozymase I
  • Diphosphopyridine nucleotide
  • DPN
  • NAD
  • NAD+
  • Nadida
  • Nadide
  • Nadidum
  • Nicotinamide adenine dinucleotide
  • Nicotinamide dinucleotide
  • Nicotinamide-adenine dinucleotide
  • Nicotineamide adenine dinucleotide
  • Oxidized diphosphopyridine nucleotide
  • Pyridine, nucleotide diphosphate
External IDs
  • BRN 3584133

Pharmacology

Indication

Not Available

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Contraindications & Blackbox Warnings
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Pharmacodynamics

Not Available

Mechanism of action
Not Available
Absorption

Not Available

Volume of distribution

Not Available

Protein binding

Not Available

Metabolism
Not Available
Route of elimination

Not Available

Half-life

Not Available

Clearance

Not Available

Adverse Effects
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Toxicity

Not Available

Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
This information should not be interpreted without the help of a healthcare provider. If you believe you are experiencing an interaction, contact a healthcare provider immediately. The absence of an interaction does not necessarily mean no interactions exist.
Not Available
Food Interactions
Not Available

Products

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Mixture Products
NameIngredientsDosageRouteLabellerMarketing StartMarketing EndRegionImage
Bonogen hair care shampooNadide (0.3 g/100g) + Biotin (0.06 g/100g) + Panthenol (0.5 g/100g) + Pyrithione zinc (2.1 g/100g)ShampooTopicalBonogen Co., Ltd2010-03-01Not applicableUS flag
Bonogen Plus hair care shampooNadide (0.3 g/100g) + Biotin (0.06 g/100g) + Panthenol (0.6 g/100g) + Pyrithione zinc (2.1 g/100g)ShampooTopicalBonogen Co., Ltd2010-04-09Not applicableUS flag
Born HairNadide (0.3 g/100g) + Biotin (0.06 g/100g) + Panthenol (0.6 g/100g) + Pyrithione zinc (2.1 g/100g)ShampooTopicalBonogen Co., Ltd2010-04-09Not applicableUS flag
Unapproved/Other Products
NameIngredientsDosageRouteLabellerMarketing StartMarketing EndRegionImage
Bonogen hair care shampooNadide (0.3 g/100g) + Biotin (0.06 g/100g) + Panthenol (0.5 g/100g) + Pyrithione zinc (2.1 g/100g)ShampooTopicalBonogen Co., Ltd2010-03-01Not applicableUS flag
Bonogen Plus hair care shampooNadide (0.3 g/100g) + Biotin (0.06 g/100g) + Panthenol (0.6 g/100g) + Pyrithione zinc (2.1 g/100g)ShampooTopicalBonogen Co., Ltd2010-04-09Not applicableUS flag
Born HairNadide (0.3 g/100g) + Biotin (0.06 g/100g) + Panthenol (0.6 g/100g) + Pyrithione zinc (2.1 g/100g)ShampooTopicalBonogen Co., Ltd2010-04-09Not applicableUS flag

Categories

Drug Categories
Chemical TaxonomyProvided by Classyfire
Description
This compound belongs to the class of organic compounds known as (5'->5')-dinucleotides. These are dinucleotides where the two bases are connected via a (5'->5')-phosphodiester linkage.
Kingdom
Organic compounds
Super Class
Nucleosides, nucleotides, and analogues
Class
(5'->5')-dinucleotides
Sub Class
Not Available
Direct Parent
(5'->5')-dinucleotides
Alternative Parents
Purine nucleotide sugars / Purine ribonucleoside diphosphates / Purine ribonucleoside monophosphates / Nicotinamide nucleotides / Pentose phosphates / Glycosylamines / Monosaccharide phosphates / 6-aminopurines / Organic pyrophosphates / Nicotinamides
show 16 more
Substituents
(5'->5')-dinucleotide / 6-aminopurine / Alcohol / Alkyl phosphate / Amine / Aminopyrimidine / Aromatic heteropolycyclic compound / Azacycle / Azole / Carboximidic acid
show 39 more
Molecular Framework
Aromatic heteropolycyclic compounds
External Descriptors
NAD (CHEBI:44215)
Affected organisms
Not Available

Chemical Identifiers

UNII
0U46U6E8UK
CAS number
53-84-9
InChI Key
BAWFJGJZGIEFAR-NNYOXOHSSA-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)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1
IUPAC Name
1-[(2R,3R,4S,5R)-5-({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono}oxy)(hydroxy)phosphoryl]oxy}methyl)-3,4-dihydroxyoxolan-2-yl]-3-(C-hydroxycarbonimidoyl)-1lambda5-pyridin-1-ylium
SMILES
NC(=O)C1=C[N+](=CC=C1)[C@@H]1O[C@H](COP([O-])(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)N2C=NC3=C2N=CN=C3N)[C@@H](O)[C@H]1O

References

General References
Not Available
ChemSpider
5681
BindingDB
213227
RxNav
1044975
ChEBI
44215
ChEMBL
CHEMBL1234613
PDBe Ligand
NAD
Wikipedia
Nicotinamide_adenine_dinucleotide
PDB Entries
1a4z / 1a5z / 1a71 / 1a7a / 1a7k / 1a9y / 1a9z / 1ad3 / 1agn / 1ahh
show 1664 more

Clinical Trials

Clinical Trials
PhaseStatusPurposeConditionsCount
2RecruitingTreatmentCoronavirus Disease 2019 (COVID‑19) / Post COVID-19 Syndrome / Post-acute COVID-19 (PACS), or "Long COVID" Syndrome1

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage Forms
FormRouteStrength
ShampooTopical
Prices
Not Available
Patents
Not Available

Properties

State
Not Available
Experimental Properties
Not Available
Predicted Properties
PropertyValueSource
Water Solubility2.14 mg/mLALOGPS
logP-1.2ALOGPS
logP-11ChemAxon
logS-2.5ALOGPS
pKa (Strongest Acidic)1.86ChemAxon
pKa (Strongest Basic)6.4ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count16ChemAxon
Hydrogen Donor Count8ChemAxon
Polar Surface Area322.08 Å2ChemAxon
Rotatable Bond Count11ChemAxon
Refractivity151.81 m3·mol-1ChemAxon
Polarizability58.5 Å3ChemAxon
Number of Rings5ChemAxon
Bioavailability0ChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon
Predicted ADMET Features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSNot Available

Drug created at June 24, 2018 16:59 / Updated at February 21, 2021 18:54