脱氧鬼臼毒素
TL;DR: 脱氧鬼臼毒素 (CAS 1212463-68-7) is a chemical compound with molecular formula C21H20O7 and molecular weight 384.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
脱氧鬼臼毒素
5-(4-hydroxy-3,5-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one
Also Known As: Deoxypodophyllotoxin, 4'-Demethyldeoxypodophyllotoxin, POLYGALA MACRADENIA B628836K043, 5-(4-hydroxy-3,5-dimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one, 5-(4-hydroxy-3,5-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one
| Molecular Formula | C21H20O7 |
|---|---|
| Molecular Weight | 384.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 83.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.1209 |
| Heavy Atoms | 28 |
| Complexity | 583.0 |
Chemical Identifiers
| CAS Number | 1212463-68-7 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)C2C3C(CC4=CC5=C(C=C24)OCO5)COC3=O |
| InChIKey | RFDMNXDDRXVJTM-UHFFFAOYSA-N |
Product Overview
脱氧鬼臼毒素 (CAS 1212463-68-7), with molecular formula C21H20O7 and molecular weight 384.12 g/mol. IUPAC: 5-(4-hydroxy-3,5-dimethoxyphenyl)-5a,8,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-6-one.
Chemical Property Profile of 脱氧鬼臼毒素
Property Insights of 脱氧鬼臼毒素
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 脱氧鬼臼毒素. The TPSA of 83.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 脱氧鬼臼毒素. Following Lipinski's Rule of Five, 脱氧鬼臼毒素 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 脱氧鬼臼毒素?
The CAS number of 脱氧鬼臼毒素 is 1212463-68-7.
What is the molecular formula of 脱氧鬼臼毒素?
The molecular formula of 脱氧鬼臼毒素 is C21H20O7.
What is the molecular weight of 脱氧鬼臼毒素?
The molecular weight of 脱氧鬼臼毒素 is 384.12 g/mol.
Where can I buy 脱氧鬼臼毒素?
You can request a quote for 脱氧鬼臼毒素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 脱氧鬼臼毒素?
Yes, KEHONG BIO provides custom synthesis services for 脱氧鬼臼毒素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.