Myrciacetin
TL;DR: Myrciacetin (CAS 203734-35-4) is a chemical compound with molecular formula C17H16O6 and molecular weight 316.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(2,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-dimethyl-2,3-dihydrochromen-4-one
Also Known As: Myrciacetin, Myriacetin, (S)-2-(2,5-Dihydroxyphenyl)-5,7-dihydroxy-6,8-dimethylchroman-4-one, (2S)-2-(2,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-dimethyl-2,3-dihydrochromen-4-one, (2S)-2-(2,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-dimethyl-chroman-4-one
| Molecular Formula | C17H16O6 |
|---|---|
| Molecular Weight | 316.09 g/mol |
| LogP | 2.83234 |
| Topological Polar Surface Area | 107.22 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 316.0947 |
| Heavy Atoms | 23 |
| Complexity | 824.5638 |
Chemical Identifiers
| CAS Number | 203734-35-4 |
|---|---|
| SMILES | CC1=C(C(=C2C(=C1O)C(=O)C[C@H](O2)C3=C(C=CC(=C3)O)O)C)O |
Product Overview
Myrciacetin (CAS 203734-35-4), with molecular formula C17H16O6 and molecular weight 316.09 g/mol. IUPAC: (2S)-2-(2,5-dihydroxyphenyl)-5,7-dihydroxy-6,8-dimethyl-2,3-dihydrochromen-4-one.
Chemical Property Profile of Myrciacetin
Property Insights of Myrciacetin
The XLogP value of 2.83234 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Myrciacetin. The TPSA of 107.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Myrciacetin. Following Lipinski's Rule of Five, Myrciacetin has 4 hydrogen bond donor(s) and 6 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 Myrciacetin?
The CAS number of Myrciacetin is 203734-35-4.
What is the molecular formula of Myrciacetin?
The molecular formula of Myrciacetin is C17H16O6.
What is the molecular weight of Myrciacetin?
The molecular weight of Myrciacetin is 316.09 g/mol.
Where can I buy Myrciacetin?
You can request a quote for Myrciacetin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Myrciacetin?
Yes, KEHONG BIO provides custom synthesis services for Myrciacetin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.