(1'E)-Dechloromycorrhizin A
TL;DR: (1'E)-Dechloromycorrhizin A (CAS 150824-26-3) is a chemical compound with molecular formula C14H16O4 and molecular weight 248.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1aR,3aS,7aS)-3a-hydroxy-2,2-dimethyl-5-[(E)-prop-1-enyl]-1,1a-dihydrocyclopropa[c][1]benzofuran-4,7-dione
Also Known As: (1'E)-Dechloromycorrhizin A, (+)-Dechloromycorrhizin A, (1'E)-dechloromycorrhizin, DECHLOROMYCORRHIZIN A, DECHLOROMYCORRHIZIN A, (+)-
| Molecular Formula | C14H16O4 |
|---|---|
| Molecular Weight | 248.10 g/mol |
| LogP | 1.1444 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.10486 |
| Heavy Atoms | 18 |
| Complexity | 527.9121 |
Chemical Identifiers
| CAS Number | 150824-26-3 |
|---|---|
| SMILES | C/C=C/C1=CC(=O)[C@]23C[C@H]2C(O[C@@]3(C1=O)O)(C)C |
Product Overview
(1'E)-Dechloromycorrhizin A (CAS 150824-26-3), with molecular formula C14H16O4 and molecular weight 248.10 g/mol. IUPAC: (1aR,3aS,7aS)-3a-hydroxy-2,2-dimethyl-5-[(E)-prop-1-enyl]-1,1a-dihydrocyclopropa[c][1]benzofuran-4,7-dione.
Chemical Property Profile of (1'E)-Dechloromycorrhizin A
Property Insights of (1'E)-Dechloromycorrhizin A
The XLogP value of 1.1444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1'E)-Dechloromycorrhizin A. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (1'E)-Dechloromycorrhizin A. Following Lipinski's Rule of Five, (1'E)-Dechloromycorrhizin A has 1 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 (1'E)-Dechloromycorrhizin A?
The CAS number of (1'E)-Dechloromycorrhizin A is 150824-26-3.
What is the molecular formula of (1'E)-Dechloromycorrhizin A?
The molecular formula of (1'E)-Dechloromycorrhizin A is C14H16O4.
What is the molecular weight of (1'E)-Dechloromycorrhizin A?
The molecular weight of (1'E)-Dechloromycorrhizin A is 248.10 g/mol.
Where can I buy (1'E)-Dechloromycorrhizin A?
You can request a quote for (1'E)-Dechloromycorrhizin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1'E)-Dechloromycorrhizin A?
Yes, KEHONG BIO provides custom synthesis services for (1'E)-Dechloromycorrhizin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.