Thio-NAD CAS 4090-29-3

• Iden­ti­fi­ca­tion
• Prop­er­ties
• Safe­ty Data
• Spec­i­fi­ca­tions & Oth­er Information
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Iden­ti­fi­ca­tion

CAS Number

4090-29-3

Name

Thio-NAD

Syn­onyms

Thion­i­coti­namide ade­nine din­u­cleotide
[4090-29-3]
MFCD00079609
Thio-NAD
THION­I­COTI­NAMIDEAD­ENINED­IN­U­CLEOTIDE
β-Thion­i­­coti­­namide ade­nine din­u­cleotide, oxi­dised form
β-Thion­i­­coti­­namide ade­nine din­u­cleotide, oxi­dised form 92+%
β-Thion­i­­coti­­namide ade­nine din­u­cleotide ; oxi­dised form

SMILES

c1cc(c[n+](c1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)OP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)O)O)O)C(=S)N

Std­InChI

InChI=1S/C21H27N7O13P2S/c22-17-12-19(25-7-24-17)28(8-26-12)21-14(31)13(30)11(39-21)6-37-42(33,34)41-43(35,36)40-16-10(5-29)38-20(15(16)32)27-3-1-2-9(4-27)18(23)44/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,44)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1

Std­InChIKey

DQR­RI­­GAX­­TAXHLR-NNY­OX­OHSSA-N

Mol­e­c­u­lar Formula

C₂₁H₂₇N₇O₁₃SP₂ 

Mol­e­c­u­lar Weight

679.49

MDL Number

MFCD00079609

Prop­er­ties

Appear­ance

Light yel­low or yel­low-green powder

Safe­ty Data

RIDADR 

NONH for all modes of transport

WGK Germany

3

Spec­i­fi­ca­tions and Oth­er Infor­ma­tion of Our Thio-NAD CAS 4090-29-3

Iden­ti­fi­ca­tion Methods

HPLC

Puri­ty

95% min

Chi­ral purity

99.99%min

Salt con­tent

≤1%

Water

≤5%

Shelf Life

One and a half years.

Stor­age

Store at -20 ℃, sealed and pro­tect­ed from light.

Known Appli­ca­tion

Used in con­junc­tion with 3α-hydrox­­ys­teroid dehy­dro­ge­nase (3α-HSD) for the devel­op­ment and mass prepa­ra­tion of total bile acid (TBA) reagents.

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