Isogingerenone B
TL;DR: Isogingerenone B (CAS 128700-99-2) is a chemical compound with molecular formula C22H26O6 and molecular weight 386.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-(4-hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one
Also Known As: Isogingerenone B, Isogingerenone-B, (4E)-1-(4-hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one, (E)-1-(4-hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one, (4E)-1-(4-Hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one
| Molecular Formula | C22H26O6 |
|---|---|
| Molecular Weight | 386.17 g/mol |
| LogP | 3.8143 |
| Topological Polar Surface Area | 85.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 386.17294 |
| Heavy Atoms | 28 |
| Complexity | 815.9109 |
Chemical Identifiers
| CAS Number | 128700-99-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)OC)CCC(=O)/C=C/CCC2=CC(=C(C=C2)O)OC |
Product Overview
Isogingerenone B (CAS 128700-99-2), with molecular formula C22H26O6 and molecular weight 386.17 g/mol. IUPAC: (E)-1-(4-hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)hept-4-en-3-one.
Chemical Property Profile of Isogingerenone B
Property Insights of Isogingerenone B
The XLogP value of 3.8143 indicates that Isogingerenone B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.22 Ų falls within the moderate polarity range, balancing permeability and solubility for Isogingerenone B. Following Lipinski's Rule of Five, Isogingerenone B has 2 hydrogen bond donor(s) and 6 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 Isogingerenone B?
The CAS number of Isogingerenone B is 128700-99-2.
What is the molecular formula of Isogingerenone B?
The molecular formula of Isogingerenone B is C22H26O6.
What is the molecular weight of Isogingerenone B?
The molecular weight of Isogingerenone B is 386.17 g/mol.
Where can I buy Isogingerenone B?
You can request a quote for Isogingerenone B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isogingerenone B?
Yes, KEHONG BIO provides custom synthesis services for Isogingerenone B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.