贝母兰素
TL;DR: 贝母兰素 (CAS 82358-31-4) is a chemical compound with molecular formula C17H16O5 and molecular weight 300.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
贝母兰素
6,7-dimethoxy-2-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),11(15),12-hexaene-5,13-diol
Also Known As: Coelogin, 9,10-Dihydro-7,8-dimethoxy-5H-phenanthro(4,5-bcd)pyran-2,6-diol, 5H-Phenanthro(4,5-bcd)pyran-2,6-diol, 9,10-dihydro-7,8-dimethoxy-, 7,8-dimethoxy-9,10-dihydro-5H-naphtho(8,1,2-cde)chromene-2,6-diol, 6,7-dimethoxy-2-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),11(15),12-hexaene-5,13-diol
| Molecular Formula | C17H16O5 |
|---|---|
| Molecular Weight | 300.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 68.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.09976 |
| Heavy Atoms | 22 |
| Complexity | 416.0 |
Chemical Identifiers
| CAS Number | 82358-31-4 |
|---|---|
| SMILES | COC1=C(C(=C2COC3=CC(=CC4=C3C2=C1CC4)O)O)OC |
| InChIKey | QLYYIQVXUQYKGV-UHFFFAOYSA-N |
Product Overview
贝母兰素 (CAS 82358-31-4), with molecular formula C17H16O5 and molecular weight 300.10 g/mol. IUPAC: 6,7-dimethoxy-2-oxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,6,8(16),11(15),12-hexaene-5,13-diol.
Chemical Property Profile of 贝母兰素
Property Insights of 贝母兰素
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 贝母兰素. The TPSA of 68.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 贝母兰素. Following Lipinski's Rule of Five, 贝母兰素 has 2 hydrogen bond donor(s) and 5 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 贝母兰素?
The CAS number of 贝母兰素 is 82358-31-4.
What is the molecular formula of 贝母兰素?
The molecular formula of 贝母兰素 is C17H16O5.
What is the molecular weight of 贝母兰素?
The molecular weight of 贝母兰素 is 300.10 g/mol.
Where can I buy 贝母兰素?
You can request a quote for 贝母兰素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 贝母兰素?
Yes, KEHONG BIO provides custom synthesis services for 贝母兰素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.