吡哆醛三磷酸酯
TL;DR: 吡哆醛三磷酸酯 (CAS 92195-86-3) is a chemical compound with molecular formula C8H12NO12P3 and molecular weight 406.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡哆醛三磷酸酯
3-hydroxy-5-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]methyl]-2-methylpyridine-4-carboxylic acid
Also Known As: Pyridoxal triphosphate, 3-hydroxy-5-[(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)methyl]-2-methylpyridine-4-carboxylic acid, Triphosphoric acid, P-((4-formyl-5-hydroxy-6-methyl-3-pyridinyl)methyl) ester, 3-hydroxy-5-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]methyl]-2-methylpyridine-4-carboxylic acid, RefChem:177720
| Molecular Formula | C8H12NO12P3 |
|---|---|
| Molecular Weight | 406.96 g/mol |
| LogP | -3.2 |
| Topological Polar Surface Area | 221.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 7 |
| Exact Mass | 406.95724 |
| Heavy Atoms | 24 |
| Complexity | 617.0 |
Chemical Identifiers
| CAS Number | 92195-86-3 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)C(=O)O)CP(=O)(O)OP(=O)(O)OP(=O)(O)O |
| InChIKey | WFYHDHNXBXNRNK-UHFFFAOYSA-N |
Product Overview
吡哆醛三磷酸酯 (CAS 92195-86-3), with molecular formula C8H12NO12P3 and molecular weight 406.96 g/mol. IUPAC: 3-hydroxy-5-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]methyl]-2-methylpyridine-4-carboxylic acid.
Chemical Property Profile of 吡哆醛三磷酸酯
Property Insights of 吡哆醛三磷酸酯
The XLogP value of -3.2 indicates that 吡哆醛三磷酸酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 221.0 Ų indicates high polarity, suggesting 吡哆醛三磷酸酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 吡哆醛三磷酸酯 has 6 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 吡哆醛三磷酸酯?
The CAS number of 吡哆醛三磷酸酯 is 92195-86-3.
What is the molecular formula of 吡哆醛三磷酸酯?
The molecular formula of 吡哆醛三磷酸酯 is C8H12NO12P3.
What is the molecular weight of 吡哆醛三磷酸酯?
The molecular weight of 吡哆醛三磷酸酯 is 406.96 g/mol.
Where can I buy 吡哆醛三磷酸酯?
You can request a quote for 吡哆醛三磷酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡哆醛三磷酸酯?
Yes, KEHONG BIO provides custom synthesis services for 吡哆醛三磷酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.