Isocyclomulberrin
TL;DR: Isocyclomulberrin (CAS 145682-71-9) is a chemical compound with molecular formula C25H24O6 and molecular weight 420.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,8,10-trihydroxy-9-(3-methylbut-2-enyl)-6-(2-methylprop-1-enyl)-6H-chromeno[4,3-b]chromen-7-one
Also Known As: Isocyclomulberrin, Cyclocommunin, 3,8,10-trihydroxy-9-(3-methylbut-2-enyl)-6-(2-methylprop-1-enyl)-6H-chromeno[4,3-b]chromen-7-one, 6H,7H-(1)Benzopyrano(4,3-b)(1)benzopyran-7-one, 3,8,10-trihydroxy-9-(3-methyl-2-butenyl)-6-(2-methyl-1-propenyl)-, (+)-, 1,3,8-TRIHYDROXY-2-(3-METHYLBUT-2-EN-1-YL)-11-(2-METHYLPROP-1-EN-1-YL)-11,12-DIHYDRO-5,10-DIOXATETRAPHEN-12-ONE
| Molecular Formula | C25H24O6 |
|---|---|
| Molecular Weight | 420.16 g/mol |
| LogP | 5.4852 |
| Topological Polar Surface Area | 100.13 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.1573 |
| Heavy Atoms | 31 |
| Complexity | 1318.3173 |
Chemical Identifiers
| CAS Number | 145682-71-9 |
|---|---|
| SMILES | CC(=CCC1=C(C2=C(C=C1O)OC3=C(C2=O)C(OC4=C3C=CC(=C4)O)C=C(C)C)O)C |
Product Overview
Isocyclomulberrin (CAS 145682-71-9), with molecular formula C25H24O6 and molecular weight 420.16 g/mol. IUPAC: 3,8,10-trihydroxy-9-(3-methylbut-2-enyl)-6-(2-methylprop-1-enyl)-6H-chromeno[4,3-b]chromen-7-one.
Chemical Property Profile of Isocyclomulberrin
Property Insights of Isocyclomulberrin
The XLogP value of 5.4852 indicates that Isocyclomulberrin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Isocyclomulberrin. Following Lipinski's Rule of Five, Isocyclomulberrin has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Isocyclomulberrin?
The CAS number of Isocyclomulberrin is 145682-71-9.
What is the molecular formula of Isocyclomulberrin?
The molecular formula of Isocyclomulberrin is C25H24O6.
What is the molecular weight of Isocyclomulberrin?
The molecular weight of Isocyclomulberrin is 420.16 g/mol.
Where can I buy Isocyclomulberrin?
You can request a quote for Isocyclomulberrin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isocyclomulberrin?
Yes, KEHONG BIO provides custom synthesis services for Isocyclomulberrin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.