dTDP-alpha-D-desosamine
TL;DR: dTDP-alpha-D-desosamine (CAS 294178-48-6) is a chemical compound with molecular formula C18H31N3O13P2 and molecular weight 559.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl] [hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate
Also Known As: TDP-D-desosamine, dTDP-alpha-D-desosamine, dTDP-D-desosamine, TDP-alpha-D-desosamine, J1.336.798A
| Molecular Formula | C18H31N3O13P2 |
|---|---|
| Molecular Weight | 559.13 g/mol |
| LogP | -5.4 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 9 |
| Exact Mass | 559.13324 |
| Heavy Atoms | 36 |
| Complexity | 978.0 |
Chemical Identifiers
| CAS Number | 294178-48-6 |
|---|---|
| SMILES | C[C@@H]1C[C@@H]([C@H]([C@H](O1)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H](C[C@@H](O2)N3C=C(C(=O)NC3=O)C)O)O)N(C)C |
| InChIKey | FFPCARSBUVGIOB-BKRCCOPCSA-N |
Product Overview
dTDP-alpha-D-desosamine (CAS 294178-48-6), with molecular formula C18H31N3O13P2 and molecular weight 559.13 g/mol. IUPAC: [(2R,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl] [hydroxy-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy]phosphoryl] hydrogen phosphate.
Chemical Property Profile of dTDP-alpha-D-desosamine
Property Insights of dTDP-alpha-D-desosamine
The XLogP value of -5.4 indicates that dTDP-alpha-D-desosamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 214.0 Ų indicates high polarity, suggesting dTDP-alpha-D-desosamine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, dTDP-alpha-D-desosamine has 5 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of dTDP-alpha-D-desosamine?
The CAS number of dTDP-alpha-D-desosamine is 294178-48-6.
What is the molecular formula of dTDP-alpha-D-desosamine?
The molecular formula of dTDP-alpha-D-desosamine is C18H31N3O13P2.
What is the molecular weight of dTDP-alpha-D-desosamine?
The molecular weight of dTDP-alpha-D-desosamine is 559.13 g/mol.
Where can I buy dTDP-alpha-D-desosamine?
You can request a quote for dTDP-alpha-D-desosamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dTDP-alpha-D-desosamine?
Yes, KEHONG BIO provides custom synthesis services for dTDP-alpha-D-desosamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.