beta-Methylmelibiose
TL;DR: beta-Methylmelibiose (CAS 107911-44-4) is a chemical compound with molecular formula C13H24O11 and molecular weight 356.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methoxy]oxane-3,4,5-triol
Also Known As: beta-Methylmelibiose, Methyl beta-melibioside, Ganciclovir monosodium salt, Methyl 6-O-alpha-D-galactopyranosyl-beta-D-glucopyranoside, (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methoxy]oxane-3,4,5-triol
| Molecular Formula | C13H24O11 |
|---|---|
| Molecular Weight | 356.13 g/mol |
| LogP | -4.2 |
| Topological Polar Surface Area | 179.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.13187 |
| Heavy Atoms | 24 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 107911-44-4 |
|---|---|
| SMILES | CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)O)O)O |
| InChIKey | ZQPVHVKWCGZNDW-YFKDRYSXSA-N |
Product Overview
beta-Methylmelibiose (CAS 107911-44-4), with molecular formula C13H24O11 and molecular weight 356.13 g/mol. IUPAC: (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[[(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-methoxyoxan-2-yl]methoxy]oxane-3,4,5-triol.
Chemical Property Profile of beta-Methylmelibiose
Property Insights of beta-Methylmelibiose
The XLogP value of -4.2 indicates that beta-Methylmelibiose is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 179.0 Ų indicates high polarity, suggesting beta-Methylmelibiose may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, beta-Methylmelibiose has 7 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of beta-Methylmelibiose?
The CAS number of beta-Methylmelibiose is 107911-44-4.
What is the molecular formula of beta-Methylmelibiose?
The molecular formula of beta-Methylmelibiose is C13H24O11.
What is the molecular weight of beta-Methylmelibiose?
The molecular weight of beta-Methylmelibiose is 356.13 g/mol.
Where can I buy beta-Methylmelibiose?
You can request a quote for beta-Methylmelibiose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Methylmelibiose?
Yes, KEHONG BIO provides custom synthesis services for beta-Methylmelibiose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.