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Nucleosides and nucleotides

NADPH tetracyclohexanamine

Also known as NADPH (tetracyclohexanamine), Beta-Nadph Tetra(Cyclohexylammonium) Salt, TPNH

CAS 100929-71-3Formula C45H82N11O17P3Molar mass 1,142.13 g/mol
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NADPH tetracyclohexanamine chemical structure, C45H82N11O17P3, CAS 100929-71-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
100929-71-3
Formula
C45H82N11O17P3
Molar mass
1,142.13 g/mol
HS code
293499
Category
Nucleosides and nucleotides

What is NADPH tetracyclohexanamine?

Plain description, key identifiers and synonyms

NADPH tetracyclohexanamine is a chemical substance with the molecular formula C45H82N11O17P3 and a molar mass of 1,142.13 g/mol. Its CAS registry number is 100929-71-3. The IUPAC name is [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate, tetrakis(cyclohexanamine).

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3-hydroxy-4-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-5-(3-carbamoyl-4H-pyridin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate, tetrakis(cyclohexanamine)
CAS number
100929-71-3 CAS number cross-checked
Molecular formula
C45H82N11O17P3
MDL number
MFCD00079504
InChIKey
PTKRUDMLGIIORX-ITGWJZMWSA-N
InChI
InChI=1S/C21H30N7O17P3.4C6H13N/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32;4*7-6-4-2-1-3-5-6/h1,3-4,7-8,10-11,13-16,20-21,29-31H,2,5-6H2,(H2,23,32)(H,36,37)(H,38,39)(H2,22,24,25)(H2,33,34,35);4*6H,1-5,7H2/t10-,11-,13-,14-,15-,16-,20-,21-;;;;/m1..../s1
Canonical SMILES
NC(=O)C1=CN(C2OC(COP(=O)(O)OP(=O)(O)OCC3OC(n4cnc5c(N)ncnc54)C(OP(=O)(O)O)C3O)C(O)C2O)C=CC1.NC1CCCCC1.NC1CCCCC1.NC1CCCCC1.NC1CCCCC1
Isomeric SMILES
C1CCC(CC1)N.C1CCC(CC1)N.C1CCC(CC1)N.C1CCC(CC1)N.C1C=CN(C=C1C(=O)N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C(N=CN=C54)N)OP(=O)(O)O)O)O)O

Synonyms

  • NADPH (tetracyclohexanamine)
  • Beta-Nadph Tetra(Cyclohexylammonium) Salt
  • TPNH
  • beta-NADPH
  • NADPHtetracyclohexanamine
  • NADPH tetra(cyclohexammoninum)
  • NADPH tetrakis(cyclohexylamine)
  • b-Nicotinamide adenine dinucleotide phosphate, reduced tetra(cyclohexylammonium)
  • Reduced beta-nicotinamide adenine dinucleotide tetracyclohexyl ammonium phosphate salt
  • beta-Nicotinamide adenine dinucleotide phosphate, reduced tetra(cyclohexylammonium) salt, >=95%

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
1,142.13 g/molcalc.
Exact mass
1,141.5103 Dacalc.
LogP (octanol/water)
2.54calc.
Topological polar surface area
468.2 Ųcalc.
Hydrogen bond donors
13calc.
Hydrogen bond acceptors
22calc.
Rotatable bonds
13calc.
Heavy atoms
76calc.
Rings
9calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.78calc.
Formal charge
0calc.
Stereocentres
10calc.
Components
5calc.
Lipinski rule of five
Fails (3 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=[PH](OCC1CCC(N2C=CCC=C2)O1)O[PH](=O)OCC1CCC(n2cnc3cncnc32)O1

O=[PH](OCC1CCC(N2C=CCC=C2)O1)O[PH](=O)OCC1CCC(n2cnc3cncnc32)O1

5 rings, 34 atoms.

36 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

NADPH tetracyclohexanamine suppliers

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All 2 suppliers

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Where suppliers are based

2 suppliers in 1 country

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NADPH tetracyclohexanamine price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code NADPH tetracyclohexanamine is traded under.

HS 2934.99Indicative HS code

Nucleic acids and their salts, other heterocyclic compounds, not elsewhere classified in heading 2934

World exports in 2024
$26.7B
+15.0% vs 2023, imports $26.3B
2019 to 2024
Top exporters
  1. Ireland26.3%
  2. China15.7%
  3. Singapore10.3%
Top importers
  1. United States24.5%
  2. Germany23.1%
  3. Japan4.5%
Reported customs values in USD, not prices.Full trade data

The HS code shown for NADPH tetracyclohexanamine is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about NADPH tetracyclohexanamine, based on the data on this page

What is NADPH tetracyclohexanamine?

NADPH tetracyclohexanamine is a chemical substance with the molecular formula C45H82N11O17P3 and a molar mass of 1,142.13 g/mol. Its CAS registry number is 100929-71-3.

What is the CAS number of NADPH tetracyclohexanamine?

The CAS registry number of NADPH tetracyclohexanamine is 100929-71-3.

What is the molecular formula and weight of NADPH tetracyclohexanamine?

The molecular formula of NADPH tetracyclohexanamine is C45H82N11O17P3 and its molar mass is 1,142.13 g/mol.

Is NADPH tetracyclohexanamine hazardous?

No GHS hazard classification for NADPH tetracyclohexanamine is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of NADPH tetracyclohexanamine?

NADPH tetracyclohexanamine is usually classified under HS code 293499 (Nucleic acids and their salts, whether or not chemically defined, other heterocyclic…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy NADPH tetracyclohexanamine?

CompoundList lists 2 suppliers of NADPH tetracyclohexanamine in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of NADPH tetracyclohexanamine?

Suppliers quote NADPH tetracyclohexanamine on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle NADPH tetracyclohexanamine

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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