Bufotoxin
TL;DR: Bufotoxin (CAS 464-81-3) is a chemical compound with molecular formula C40H60N4O10 and molecular weight 756.43097 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[8-[[(3S,5R,10S,13R,14S,16S,17R)-16-acetyloxy-14-hydroxy-10,13-dimethyl-17-(2-oxopyran-4-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-8-oxooctanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Also Known As: Bufotoxin, 2-[[8-[[(3S,5R,10S,13R,14S,16S,17R)-16-acetyloxy-14-hydroxy-10,13-dimethyl-17-(2-oxopyran-4-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-8-oxooctanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid, N~2~-(8-{[(8xi,9xi)-16beta-(Acetyloxy)-14-hydroxy-17beta-(2-oxo-2H-pyran-4-yl)-5beta,14beta-androstan-3beta-yl]oxy}-1-hydroxy-8-oxooctylidene)arginine, N~2~-(8-{[16-(Acetyloxy)-14-hydroxy-17-(2-oxo-2H-pyran-4-yl)androstan-3-yl]oxy}-1-hydroxy-8-oxooctylidene)arginine
Technical Specifications
| Molecular Formula | C40H60N4O10 |
| Molecular Weight | 756.43097 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 230.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 18 |
| Exact Mass | 756.43097 Da |
| Heavy Atoms | 54 |
| Complexity | 1530.0 |
| SMILES | CC(=O)O[C@H]1C[C@@]2(C3CC[C@@H]4C[C@H](CC[C@@]4(C3CC[C@@]2([C@H]1C5=CC(=O)OC=C5)C)C)OC(=O)CCCCCCC(=O)NC(CCCN=C(N)N)C(=O)O)O |
| InChIKey | IHGHEVRUMFTXHS-UQBAYTCGSA-N |
Product Description
Applications: Bufotoxin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Bufotoxin (CAS 464-81-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, Bufotoxin (CAS 464-81-3) has the molecular formula C40H60N4O10 and a molecular weight of 756.43 g/mol. It is also known as Bufotoxin and 2-[[8-[[(3S,5R,10S,13R,14S,16S,17R)-16-acetyloxy-14-hydroxy-10,13-dimethyl-17-(2-oxopyran-4-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-8-oxooctanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Bufotoxin
Property Insights of Bufotoxin
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bufotoxin. The TPSA of 230.0 Ų indicates high polarity, suggesting Bufotoxin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bufotoxin has 5 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Bufotoxin?
The CAS number of Bufotoxin is 464-81-3.
What is the molecular formula of Bufotoxin?
The molecular formula of Bufotoxin is C40H60N4O10.
What is the molecular weight of Bufotoxin?
The molecular weight of Bufotoxin is 756.43097 g/mol.
What are the applications of Bufotoxin?
Bufotoxin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Bufotoxin (CAS 464-81-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Where can I buy Bufotoxin?
You can request a quote for Bufotoxin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bufotoxin?
Yes, CoreyChem provides custom synthesis services for Bufotoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.