Ferutinin
TL;DR: Ferutinin (CAS 41743-44-6) is a chemical compound with molecular formula C22H30O4 and molecular weight 358.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3R,3aS,4S,8aR)-3-hydroxy-6,8a-dimethyl-3-propan-2-yl-1,2,3a,4,5,8-hexahydroazulen-4-yl] 4-hydroxybenzoate
Also Known As: Ferutinin, Ferutinine, Tefestrol, Jaeschkeanadiol p-hydroxybenzoate, From Ferula tingiatana
| Molecular Formula | C22H30O4 |
|---|---|
| Molecular Weight | 358.21 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.21442 |
| Heavy Atoms | 26 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 41743-44-6 |
|---|---|
| SMILES | CC1=CC[C@]2(CC[C@]([C@@H]2[C@H](C1)OC(=O)C3=CC=C(C=C3)O)(C(C)C)O)C |
| InChIKey | CYSHNJQMYORNJI-YUVXSKOASA-N |
Product Overview
Ferutinin (CAS 41743-44-6), with molecular formula C22H30O4 and molecular weight 358.21 g/mol. IUPAC: [(3R,3aS,4S,8aR)-3-hydroxy-6,8a-dimethyl-3-propan-2-yl-1,2,3a,4,5,8-hexahydroazulen-4-yl] 4-hydroxybenzoate.
Chemical Property Profile of Ferutinin
Property Insights of Ferutinin
The XLogP value of 4.5 indicates that Ferutinin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ferutinin. Following Lipinski's Rule of Five, Ferutinin has 2 hydrogen bond donor(s) and 4 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 Ferutinin?
The CAS number of Ferutinin is 41743-44-6.
What is the molecular formula of Ferutinin?
The molecular formula of Ferutinin is C22H30O4.
What is the molecular weight of Ferutinin?
The molecular weight of Ferutinin is 358.21 g/mol.
Where can I buy Ferutinin?
You can request a quote for Ferutinin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ferutinin?
Yes, KEHONG BIO provides custom synthesis services for Ferutinin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.