6,8-O-Dimethylversicolorin B
TL;DR: 6,8-O-Dimethylversicolorin B (CAS 62057-57-2) is a chemical compound with molecular formula C20H16O7 and molecular weight 368.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,8R)-2-hydroxy-16,18-dimethoxy-7,9-dioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),11,14(19),15,17-hexaene-13,20-dione
Also Known As: 6,8-O-Dimethylversicolorin B, NIOSH/CB1752000, 2-Butyl-5,6-dihydro-2,4-dimethyl-2H-pyran, Anthra(2,3-b)furo(3,2-d)furan-5,10-dione, 2,3,3a,12a-tetrahydro-6,8-dimethoxy-4-hydroxy-, Anthra(2,3-b)furo(2,3-d)furan-5,10-dione, 2,3,3a,12a-tetrahydro-4-hydroxy-6,8-dimethoxy-, cis-(-)-
| Molecular Formula | C20H16O7 |
|---|---|
| Molecular Weight | 368.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 368.0896 |
| Heavy Atoms | 27 |
| Complexity | 636.0 |
Chemical Identifiers
| CAS Number | 62057-57-2 |
|---|---|
| SMILES | COC1=CC2=C(C(=C1)OC)C(=O)C3=C(C4=C(C=C3C2=O)O[C@@H]5[C@H]4CCO5)O |
| InChIKey | NZRQTYSAMANXPT-GWNMQOMSSA-N |
Product Overview
6,8-O-Dimethylversicolorin B (CAS 62057-57-2), with molecular formula C20H16O7 and molecular weight 368.09 g/mol. IUPAC: (4S,8R)-2-hydroxy-16,18-dimethoxy-7,9-dioxapentacyclo[10.8.0.03,10.04,8.014,19]icosa-1,3(10),11,14(19),15,17-hexaene-13,20-dione.
Chemical Property Profile of 6,8-O-Dimethylversicolorin B
Property Insights of 6,8-O-Dimethylversicolorin B
The XLogP value of 3.0 indicates that 6,8-O-Dimethylversicolorin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 6,8-O-Dimethylversicolorin B. Following Lipinski's Rule of Five, 6,8-O-Dimethylversicolorin B has 1 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 6,8-O-Dimethylversicolorin B?
The CAS number of 6,8-O-Dimethylversicolorin B is 62057-57-2.
What is the molecular formula of 6,8-O-Dimethylversicolorin B?
The molecular formula of 6,8-O-Dimethylversicolorin B is C20H16O7.
What is the molecular weight of 6,8-O-Dimethylversicolorin B?
The molecular weight of 6,8-O-Dimethylversicolorin B is 368.09 g/mol.
Where can I buy 6,8-O-Dimethylversicolorin B?
You can request a quote for 6,8-O-Dimethylversicolorin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,8-O-Dimethylversicolorin B?
Yes, KEHONG BIO provides custom synthesis services for 6,8-O-Dimethylversicolorin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.