4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate
TL;DR: 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate (CAS 19988-33-1) is a chemical compound with molecular formula C10H15N2O8P and molecular weight 322.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methylamino]oxyacetic acid
Also Known As: PLP-AOA, 4'-DEOXY-4'-ACETYLYAMINO-PYRIDOXAL-5'-PHOSPHATE, 2-((3-Hydroxy-2-methyl-5-(phosphonooxymethyl)pyridin-4-yl)methylamino)oxyaceticacid, Acetic acid, 2-((((3-hydroxy-2-methyl-5-((phosphonooxy)methyl)-4-pyridinyl)methyl)amino)oxy)-, {[({3-hydroxy-2-methyl-5-[(phosphonooxy)methyl]pyridin-4-yl}methyl)amino]oxy}acetic acid
| Molecular Formula | C10H15N2O8P |
|---|---|
| Molecular Weight | 322.06 g/mol |
| LogP | -3.8 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 322.0566 |
| Heavy Atoms | 21 |
| Complexity | 389.0 |
Chemical Identifiers
| CAS Number | 19988-33-1 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)CNOCC(=O)O)COP(=O)(O)O |
| InChIKey | QYKRUCBLHROXCK-UHFFFAOYSA-N |
Product Overview
4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate (CAS 19988-33-1), with molecular formula C10H15N2O8P and molecular weight 322.06 g/mol. IUPAC: 2-[[3-hydroxy-2-methyl-5-(phosphonooxymethyl)-4-pyridinyl]methylamino]oxyacetic acid.
Chemical Property Profile of 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate
Property Insights of 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate
The XLogP value of -3.8 indicates that 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 158.0 Ų indicates high polarity, suggesting 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate?
The CAS number of 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate is 19988-33-1.
What is the molecular formula of 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate?
The molecular formula of 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate is C10H15N2O8P.
What is the molecular weight of 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate?
The molecular weight of 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate is 322.06 g/mol.
Where can I buy 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate?
You can request a quote for 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate?
Yes, KEHONG BIO provides custom synthesis services for 4'-Deoxy-4'-Acetylyamino-Pyridoxal-5'-Phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.