calyxin B
TL;DR: calyxin B (CAS 164991-53-1) is a chemical compound with molecular formula C35H34O8 and molecular weight 582.22534 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-1-[2,4-dihydroxy-3-[(E,1S,5S)-5-hydroxy-1,7-bis(4-hydroxyphenyl)hept-2-enyl]-6-methoxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one
Also Known As: calyxin B, CalyxinB, HY-N3527, Silane,(3-hexyl-2,5-thiophenediyl)bis[trimethyl, (E)-1-[2,4-Dihydroxy-3-[(E,1S,5S)-5-hydroxy-1,7-bis(4-hydroxyphenyl)hept-2-enyl]-6-methoxyphenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one
Technical Specifications
| Molecular Formula | C35H34O8 |
| Molecular Weight | 582.22534 g/mol |
| XLogP | 6.8 |
| Topological Polar Surface Area (TPSA) | 148.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 582.22534 Da |
| Heavy Atoms | 43 |
| Complexity | 882.0 |
| SMILES | COC1=C(C(=C(C(=C1)O)[C@@H](/C=C/C[C@H](CCC2=CC=C(C=C2)O)O)C3=CC=C(C=C3)O)O)C(=O)/C=C/C4=CC=C(C=C4)O |
| InChIKey | DHYXVFFHVYUZJU-PEVIGJGQSA-N |
Chemical Property Profile of calyxin B
Property Insights of calyxin B
The XLogP value of 6.8 indicates that calyxin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 148.0 Ų indicates high polarity, suggesting calyxin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, calyxin B has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of calyxin B?
The CAS number of calyxin B is 164991-53-1.
What is the molecular formula of calyxin B?
The molecular formula of calyxin B is C35H34O8.
What is the molecular weight of calyxin B?
The molecular weight of calyxin B is 582.22534 g/mol.
Where can I buy calyxin B?
You can request a quote for calyxin B directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for calyxin B?
Yes, CoreyChem provides custom synthesis services for calyxin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.