5,6-Dimethoxysterigmatocystin
TL;DR: 5,6-Dimethoxysterigmatocystin (CAS 65176-75-2) is a chemical compound with molecular formula C20H16O8 and molecular weight 384.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
15-hydroxy-11,17,18-trimethoxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1,4,9,11,14(19),15,17-heptaen-13-one
Also Known As: 5,6-Dimethoxysterigmatocystin, dimethoxysterigmatocystin, 10,11-Dimethoxysterigmatocystin, 15-hydroxy-11,17,18-trimethoxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1,4,9,11,14(19),15,17-heptaen-13-one, 8-hydroxy-6,10,11-trimethoxy-3a,12c-dihydro-7H-furo[3',2':4,5]furo[2,3-c]xanthen-7-one
| Molecular Formula | C20H16O8 |
|---|---|
| Molecular Weight | 384.08 g/mol |
| LogP | 3.0236 |
| Topological Polar Surface Area | 96.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.0845 |
| Heavy Atoms | 28 |
| Complexity | 1223.0514 |
Chemical Identifiers
| CAS Number | 65176-75-2 |
|---|---|
| SMILES | COC1=C(C2=C(C(=C1)O)C(=O)C3=C(C=C4C(=C3O2)C5C=COC5O4)OC)OC |
Product Overview
5,6-Dimethoxysterigmatocystin (CAS 65176-75-2), with molecular formula C20H16O8 and molecular weight 384.08 g/mol. IUPAC: 15-hydroxy-11,17,18-trimethoxy-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1,4,9,11,14(19),15,17-heptaen-13-one.
Chemical Property Profile of 5,6-Dimethoxysterigmatocystin
Property Insights of 5,6-Dimethoxysterigmatocystin
The XLogP value of 3.0236 indicates that 5,6-Dimethoxysterigmatocystin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Dimethoxysterigmatocystin. Following Lipinski's Rule of Five, 5,6-Dimethoxysterigmatocystin has 1 hydrogen bond donor(s) and 8 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 5,6-Dimethoxysterigmatocystin?
The CAS number of 5,6-Dimethoxysterigmatocystin is 65176-75-2.
What is the molecular formula of 5,6-Dimethoxysterigmatocystin?
The molecular formula of 5,6-Dimethoxysterigmatocystin is C20H16O8.
What is the molecular weight of 5,6-Dimethoxysterigmatocystin?
The molecular weight of 5,6-Dimethoxysterigmatocystin is 384.08 g/mol.
Where can I buy 5,6-Dimethoxysterigmatocystin?
You can request a quote for 5,6-Dimethoxysterigmatocystin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dimethoxysterigmatocystin?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dimethoxysterigmatocystin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.