• Name

  2-[3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazoniol-5-yl]ethyl dihydrogen diphosphate

• EINECS 205-230-7
• CAS No. 136-09-4
• Article Data3
• CAS DataBase
• Density g/cm³
• Solubility 77g/L at 20℃
• Melting Point
• Formula C12H18 N4 O7 P2 S
• Boiling Point °Cat760mmHg
• Molecular Weight 424.311
• Flash Point °C
• Transport Information
• Appearance
• Safety
• Risk Codes
• Molecular Structure
• Hazard Symbols
• Synonyms Thiazolium,3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-(4,6,6-trihydroxy-3,5-dioxa-4,6-diphosphahex-1-yl)-,hydroxide, inner salt, P,P'-dioxide; Thiamin pyrophosphate; Thiaminepyrophosphate
• PSA 233.48000
• LogP 2.67130

Synthetic route

70-16-6

Aneurin

136-09-4

thiamine pyrophosphate

Conditions

Conditions	Yield
With thiamin pyrophosphokinase; ATP; magnesium chloride In water at 20℃; for 12h; pH=8;	75%

137-00-8

5-hydroxyethyl-4-methylthiazole

73-67-6

2-methyl-4-amino-5-hydroxymethylpyrimidine

136-09-4

thiamine pyrophosphate

Conditions

Conditions	Yield
With HMP-pyrimidine kinase; thiamin phosphate synthase; thiazole kinase; thiamin phosphate kinase; ATP In water at 20℃; for 12h; pH=8;	71%

136-09-4

thiamine pyrophosphate

69103-75-9

methyl sodium acetyl phosphonate

72040-70-1

3-(4-amino-2-methyl-pyrimidin-5-ylmethyl)-2-[1-hydroxy-1-(hydroxy-methoxy-phosphoryl)-ethyl]-4-methyl-5-(2-trihydroxydiphosphoryloxy-ethyl)-thiazolium betaine

Conditions

Conditions	Yield
In water

325775-28-8

1-oxopropylphosphinic acid

136-09-4

thiamine pyrophosphate

C15H25N4O10P3S

Conditions

Conditions	Yield
With glyoxylate carboligase I393A variant; potassium chloride; flavin adenine dinucleotide; magnesium chloride In aq. phosphate buffer at 37℃; pH=7.7; Enzymatic reaction;

2706-75-4

sodium glyoxylate

136-09-4

thiamine pyrophosphate

C14H19N4O10P2S(1-)*Na(1+)

Conditions

Conditions	Yield
With glyoxylate carboligase I393A variant; flavin adenine dinucleotide; magnesium chloride In aq. phosphate buffer at 37℃; pH=7.7; Enzymatic reaction;

50654-76-7

acetylphosphinate

136-09-4

thiamine pyrophosphate

C14H23N4O10P3S

Conditions

Conditions	Yield
With glyoxylate carboligase I393A variant; flavin adenine dinucleotide; magnesium chloride In aq. phosphate buffer at 37℃; pH=7.7; Enzymatic reaction;

63502-77-2

methyl hydrogen acetylphosphonate

136-09-4

thiamine pyrophosphate

C15H25N4O11P3S

Conditions

Conditions	Yield
With glyoxylate carboligase I393A variant; potassium chloride; flavin adenine dinucleotide; magnesium chloride In aq. phosphate buffer at 37℃; pH=7.7; Enzymatic reaction;

113-24-6

sodium pyruvate

136-09-4

thiamine pyrophosphate

C15H21N4O10P2S(1-)*Na(1+)

Conditions

Conditions	Yield
With glyoxylate carboligase I393A variant; potassium chloride; flavin adenine dinucleotide; magnesium chloride In aq. phosphate buffer at 37℃; pH=7.7; Reagent/catalyst; Enzymatic reaction;