Angustone B
TL;DR: Angustone B (CAS 100462-54-2) 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.
5,7-dihydroxy-3-(5-hydroxy-2,2-dimethylchromen-6-yl)-6-(3-methylbut-2-enyl)chromen-4-one
Also Known As: Angustone B, 5,7-dihydroxy-3-(5-hydroxy-2,2-dimethylchromen-6-yl)-6-(3-methylbut-2-enyl)chromen-4-one, 5,7,5'-Trihydroxy-2',2'-dimethyl-6-(3-methyl-but-2-enyl)-2'H-(3,6')bi(1-benzopyranyl)-4-one, 5,5',7-Trihydroxy-2',2'-dimethyl-6-(3-methylbut-2-en-1-yl)-2'H,4H-[3,6'-bichromen]-4-one, 4H-1-Benzopyran-4-one,5,7-dihydroxy-3-(5-hydroxy-2,2-dimethyl-2H-1-benzopyran-6-yl)-6-(3-methyl-2-buten-1-yl)-
| Molecular Formula | C25H24O6 |
|---|---|
| Molecular Weight | 420.16 g/mol |
| LogP | 5.2697 |
| 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 | 1320.3173 |
Chemical Identifiers
| CAS Number | 100462-54-2 |
|---|---|
| SMILES | CC(=CCC1=C(C2=C(C=C1O)OC=C(C2=O)C3=C(C4=C(C=C3)OC(C=C4)(C)C)O)O)C |
Product Overview
Angustone B (CAS 100462-54-2), with molecular formula C25H24O6 and molecular weight 420.16 g/mol. IUPAC: 5,7-dihydroxy-3-(5-hydroxy-2,2-dimethylchromen-6-yl)-6-(3-methylbut-2-enyl)chromen-4-one.
Chemical Property Profile of Angustone B
Property Insights of Angustone B
The XLogP value of 5.2697 indicates that Angustone B 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 Angustone B. Following Lipinski's Rule of Five, Angustone B 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 Angustone B?
The CAS number of Angustone B is 100462-54-2.
What is the molecular formula of Angustone B?
The molecular formula of Angustone B is C25H24O6.
What is the molecular weight of Angustone B?
The molecular weight of Angustone B is 420.16 g/mol.
Where can I buy Angustone B?
You can request a quote for Angustone B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Angustone B?
Yes, KEHONG BIO provides custom synthesis services for Angustone B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.