Myrtucommulone B
TL;DR: Myrtucommulone B (CAS 54247-23-3) is a chemical compound with molecular formula C24H30O6 and molecular weight 414.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,8-dihydroxy-2,2,4,4-tetramethyl-5-(2-methylpropanoyl)-9-propan-2-yl-9H-xanthene-1,3-dione
Also Known As: Myrtucommulone B, 6,8-dihydroxy-2,2,4,4-tetramethyl-5-(2-methylpropanoyl)-9-propan-2-yl-9H-xanthene-1,3-dione, 4,9-Dihydro-6,8-dihydroxy-2,2,4,4-tetramethyl-9-(1-methylethyl)-5-(2-methyl-1-oxopropyl)-1H-xanthene-1,3(2H)-dione, 6,8-Dihydroxy-2,2,4,4-tetramethyl-5-(2-methylpropanoyl)-9-(propan-2-yl)-4,9-dihydro-1H-xanthene-1,3(2H)-dione, 4,9-Dihydro-6,8-dihydroxy-2,2,4,4-tetramethyl-9- -5- -1H-xanthene-1,3 -dione
| Molecular Formula | C24H30O6 |
|---|---|
| Molecular Weight | 414.20 g/mol |
| LogP | 4.5268 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 414.20422 |
| Heavy Atoms | 30 |
| Complexity | 1007.01276 |
Chemical Identifiers
| CAS Number | 54247-23-3 |
|---|---|
| SMILES | CC(C)C1C2=C(C(=C(C=C2O)O)C(=O)C(C)C)OC3=C1C(=O)C(C(=O)C3(C)C)(C)C |
Product Overview
Myrtucommulone B (CAS 54247-23-3), with molecular formula C24H30O6 and molecular weight 414.20 g/mol. IUPAC: 6,8-dihydroxy-2,2,4,4-tetramethyl-5-(2-methylpropanoyl)-9-propan-2-yl-9H-xanthene-1,3-dione.
Chemical Property Profile of Myrtucommulone B
Property Insights of Myrtucommulone B
The XLogP value of 4.5268 indicates that Myrtucommulone B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Myrtucommulone B. Following Lipinski's Rule of Five, Myrtucommulone B has 2 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 Myrtucommulone B?
The CAS number of Myrtucommulone B is 54247-23-3.
What is the molecular formula of Myrtucommulone B?
The molecular formula of Myrtucommulone B is C24H30O6.
What is the molecular weight of Myrtucommulone B?
The molecular weight of Myrtucommulone B is 414.20 g/mol.
Where can I buy Myrtucommulone B?
You can request a quote for Myrtucommulone B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Myrtucommulone B?
Yes, KEHONG BIO provides custom synthesis services for Myrtucommulone B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.