卷线孢菌素
TL;DR: 卷线孢菌素 (CAS 21879-81-2) is a chemical compound with molecular formula C16H16O8 and molecular weight 336.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
卷线孢菌素
(5R,6R,7S)-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-6,8-dihydro-5H-anthracene-1,4-dione
Also Known As: Bostrycin, Rhodosporin, (5R,6R,7S)-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-6,8-dihydro-5H-anthracene-1,4-dione, 1,2,3,4-Tetrahydro-1-beta,2-beta,3-beta,5,8-pentahydroxy-6-methoxy-3-methylanthraquinone, Anthraquinone, 1,2,3,4-tetrahydro-1-beta,2-beta,3-beta,5,8-pentahydroxy-6-methoxy-3-methyl-
| Molecular Formula | C16H16O8 |
|---|---|
| Molecular Weight | 336.08 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 336.0845 |
| Heavy Atoms | 24 |
| Complexity | 601.0 |
Chemical Identifiers
| CAS Number | 21879-81-2 |
|---|---|
| SMILES | C[C@@]1(CC2=C([C@H]([C@H]1O)O)C(=C3C(=O)C=C(C(=O)C3=C2O)OC)O)O |
| InChIKey | ZQNOLGRKZRDRQO-OAGGEKHMSA-N |
Product Overview
卷线孢菌素 (CAS 21879-81-2), with molecular formula C16H16O8 and molecular weight 336.08 g/mol. IUPAC: (5R,6R,7S)-5,6,7,9,10-pentahydroxy-2-methoxy-7-methyl-6,8-dihydro-5H-anthracene-1,4-dione.
Chemical Property Profile of 卷线孢菌素
Property Insights of 卷线孢菌素
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 卷线孢菌素. The TPSA of 145.0 Ų indicates high polarity, suggesting 卷线孢菌素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 卷线孢菌素 has 5 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 卷线孢菌素?
The CAS number of 卷线孢菌素 is 21879-81-2.
What is the molecular formula of 卷线孢菌素?
The molecular formula of 卷线孢菌素 is C16H16O8.
What is the molecular weight of 卷线孢菌素?
The molecular weight of 卷线孢菌素 is 336.08 g/mol.
Where can I buy 卷线孢菌素?
You can request a quote for 卷线孢菌素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 卷线孢菌素?
Yes, KEHONG BIO provides custom synthesis services for 卷线孢菌素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.