Dryocrassin ABBA
TL;DR: Dryocrassin ABBA (CAS 12777-70-7) is a chemical compound with molecular formula C43H48O16 and molecular weight 820.29425 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-acetyl-4-[[3-[[3-[(5-acetyl-2,6-dihydroxy-3,3-dimethyl-4-oxocyclohexa-1,5-dien-1-yl)methyl]-5-butanoyl-2,4,6-trihydroxyphenyl]methyl]-5-butanoyl-2,4,6-trihydroxyphenyl]methyl]-3,5-dihydroxy-6,6-dimethylcyclohexa-2,4-dien-1-one
Also Known As: Dryocrassin ABBA, Dryocrassin, DryocrassinABBA, Tetraalbaspidin ABBA, Dryocrassin-ABBA
Technical Specifications
| Molecular Formula | C43H48O16 |
| Molecular Weight | 820.29425 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 305.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 14 |
| Exact Mass | 820.29425 Da |
| Heavy Atoms | 59 |
| Complexity | 1760.0 |
| SMILES | CCCC(=O)C1=C(C(=C(C(=C1O)CC2=C(C(C(=O)C(=C2O)C(=O)C)(C)C)O)O)CC3=C(C(=C(C(=C3O)C(=O)CCC)O)CC4=C(C(C(=O)C(=C4O)C(=O)C)(C)C)O)O)O |
| InChIKey | PRVKSKWNDSLRBY-UHFFFAOYSA-N |
Chemical Property Profile of Dryocrassin ABBA
Property Insights of Dryocrassin ABBA
The XLogP value of 5.2 indicates that Dryocrassin ABBA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 305.0 Ų indicates high polarity, suggesting Dryocrassin ABBA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Dryocrassin ABBA has 10 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Dryocrassin ABBA?
The CAS number of Dryocrassin ABBA is 12777-70-7.
What is the molecular formula of Dryocrassin ABBA?
The molecular formula of Dryocrassin ABBA is C43H48O16.
What is the molecular weight of Dryocrassin ABBA?
The molecular weight of Dryocrassin ABBA is 820.29425 g/mol.
Where can I buy Dryocrassin ABBA?
You can request a quote for Dryocrassin ABBA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dryocrassin ABBA?
Yes, CoreyChem provides custom synthesis services for Dryocrassin ABBA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.