Methylhesperidin
TL;DR: Methylhesperidin (CAS 28034-80-2) is a chemical compound with molecular formula C29H36O15 and molecular weight 624.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(3,4-dimethoxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one
Also Known As: Methyl hesperidin, Methylhesperidin, Methyl-Hesperidin, Methyl Hesperidine, Methylated hesperidine
| Molecular Formula | C29H36O15 |
|---|---|
| Molecular Weight | 624.21 g/mol |
| LogP | -0.8536 |
| Topological Polar Surface Area | 223.29 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 8 |
| Exact Mass | 624.20544 |
| Heavy Atoms | 44 |
| Complexity | 1336.087 |
Chemical Identifiers
| CAS Number | 28034-80-2 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)OC3=CC(=C4C(=O)C[C@H](OC4=C3)C5=CC(=C(C=C5)OC)OC)O)O)O)O)O)O)O |
Product Overview
Methylhesperidin (CAS 28034-80-2), with molecular formula C29H36O15 and molecular weight 624.21 g/mol. IUPAC: (2S)-2-(3,4-dimethoxyphenyl)-5-hydroxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one.
Chemical Property Profile of Methylhesperidin
Property Insights of Methylhesperidin
The XLogP value of -0.8536 indicates that Methylhesperidin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 223.29 Ų indicates high polarity, suggesting Methylhesperidin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methylhesperidin has 7 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methylhesperidin?
The CAS number of Methylhesperidin is 28034-80-2.
What is the molecular formula of Methylhesperidin?
The molecular formula of Methylhesperidin is C29H36O15.
What is the molecular weight of Methylhesperidin?
The molecular weight of Methylhesperidin is 624.21 g/mol.
Where can I buy Methylhesperidin?
You can request a quote for Methylhesperidin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methylhesperidin?
Yes, KEHONG BIO provides custom synthesis services for Methylhesperidin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.