Account 2-(3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-4-methylthiazol-3-ium-5-yl)ethyl trihydrogen triphosphate
- Catalog No. :
- ACCJLV777
- CAS No. :
- 3475-65-8
- Molecular Formula :
- C12H20ClN4O10P3S
- Molecular Weight :
- 540.75
IUPAC Name:3-((4-amino-2-methylpyrimidin-5-yl)methyl)-5-(2-((hydroxy((hydroxy(phosphonooxy)phosphoryl)oxy)phosphoryl)oxy)ethyl)-4-methylthiazol-3-ium chloride
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Product Information
| Product Name | 2-(3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-4-methylthiazol-3-ium-5-yl)ethyl trihydrogen triphosphate |
|---|---|
| IUPAC Name | 3-((4-amino-2-methylpyrimidin-5-yl)methyl)-5-(2-((hydroxy((hydroxy(phosphonooxy)phosphoryl)oxy)phosphoryl)oxy)ethyl)-4-methylthiazol-3-ium chloride |
| Molecular Formula | C12H20ClN4O10P3S |
| Molecular Weight | 540.75 |
| SMILES | CC1=NC=C(C[N+]2=CSC(CCOP(=O)(O)OP(=O)(O)OP(=O)(O)O)=C2C)C(N)=N1.[Cl-] |
| InChI Key | QQGUUJDJIKOGLR-UHFFFAOYSA-N |
| Synonym | C03028;thiamine(1+) triphosphate(1-);IWLROWZYZPNOFC-UHFFFAOYSA-N;Thiazolium, 3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-(4,6,8,8-tetrahydroxy-4,6,8-trioxido-3,5,7-trioxa-4,6,8-triphosphaoct-1-yl)-, inner salt;Thiamine Triphosphate Trioctylamine;Rasagiline Impurity 33-13C3;Tocopherol Impurity 15;Thiamine Impurity 38 |
| CAS No. | 3475-65-8 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACCJLV777 Molecular Building Block Synthetic Route
3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-5-(2-((hydroxy((hydroxy(phosphonooxy)phosphoryl)oxy)phosphoryl)oxy)ethyl)-4-methylthiazol-3-ium chloride
3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-5-(2-((hydroxy(phosphonooxy)phosphoryl)oxy)ethyl)-4-methylthiazol-3-ium chloride
2-(3-((4-Amino-2-methylpyrimidin-5-yl)methyl)-4-methylthiazol-3-ium-5-yl)ethyl dihydrogen diphosphate