Dihydromelilotoside
TL;DR: Dihydromelilotoside (CAS 900787-01-1) is a chemical compound with molecular formula C15H20O8 and molecular weight 328.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propanoic acid
Also Known As: Dihydromelilotoside, Compound NP-025238, 3-[2-(beta-D-Glucopyranosyloxy)phenyl]propanoic acid, 2-(beta-D-Glucopyranosyloxy)benzenepropionic acid, 3-[2-(beta-D-Glucopyranosyloxy)phenyl]propionic acid
| Molecular Formula | C15H20O8 |
|---|---|
| Molecular Weight | 328.12 g/mol |
| LogP | -1.1175 |
| Topological Polar Surface Area | 136.68 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 328.1158 |
| Heavy Atoms | 23 |
| Complexity | 531.9631 |
Chemical Identifiers
| CAS Number | 900787-01-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CCC(=O)O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O |
Product Overview
Dihydromelilotoside (CAS 900787-01-1), with molecular formula C15H20O8 and molecular weight 328.12 g/mol. IUPAC: 3-[2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]propanoic acid.
Chemical Property Profile of Dihydromelilotoside
Property Insights of Dihydromelilotoside
The XLogP value of -1.1175 indicates that Dihydromelilotoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 136.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydromelilotoside. Following Lipinski's Rule of Five, Dihydromelilotoside has 5 hydrogen bond donor(s) and 7 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 Dihydromelilotoside?
The CAS number of Dihydromelilotoside is 900787-01-1.
What is the molecular formula of Dihydromelilotoside?
The molecular formula of Dihydromelilotoside is C15H20O8.
What is the molecular weight of Dihydromelilotoside?
The molecular weight of Dihydromelilotoside is 328.12 g/mol.
Where can I buy Dihydromelilotoside?
You can request a quote for Dihydromelilotoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydromelilotoside?
Yes, KEHONG BIO provides custom synthesis services for Dihydromelilotoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.