Garcinone B
TL;DR: Garcinone B (CAS 76996-28-6) is a chemical compound with molecular formula C23H22O6 and molecular weight 394.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,9,11-trihydroxy-3,3-dimethyl-10-(3-methylbut-2-enyl)pyrano[3,2-a]xanthen-12-one
Also Known As: garcinone B, 5,9,11-trihydroxy-3,3-dimethyl-10-(3-methylbut-2-enyl)pyrano[3,2-a]xanthen-12-one, 6,8,12-trihydroxy-2,2-dimethyl-7-(3-methylbut-2-en-1-yl)-2,5-dihydro-1,10-dioxatetraphen-5-one, 5,9,11-Trihydroxy-3,3-dimethyl-10-(3-methylbut-2-en-1-yl)pyrano[3,2-a]xanthen-12(3H)-one, 3,3-Dimethyl-5,9,11-trihydroxy-10-(3-methyl-2-butenyl)pyrano[3,2-a]xanthen-12(3H)-one
| Molecular Formula | C23H22O6 |
|---|---|
| Molecular Weight | 394.14 g/mol |
| LogP | 4.7559 |
| Topological Polar Surface Area | 100.13 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 394.14163 |
| Heavy Atoms | 29 |
| Complexity | 1286.9327 |
Chemical Identifiers
| CAS Number | 76996-28-6 |
|---|---|
| SMILES | CC(=CCC1=C(C2=C(C=C1O)OC3=C(C2=O)C4=C(C(=C3)O)OC(C=C4)(C)C)O)C |
Product Overview
Garcinone B (CAS 76996-28-6), with molecular formula C23H22O6 and molecular weight 394.14 g/mol. IUPAC: 5,9,11-trihydroxy-3,3-dimethyl-10-(3-methylbut-2-enyl)pyrano[3,2-a]xanthen-12-one.
Chemical Property Profile of Garcinone B
Property Insights of Garcinone B
The XLogP value of 4.7559 indicates that Garcinone 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 Garcinone B. Following Lipinski's Rule of Five, Garcinone B has 3 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 Garcinone B?
The CAS number of Garcinone B is 76996-28-6.
What is the molecular formula of Garcinone B?
The molecular formula of Garcinone B is C23H22O6.
What is the molecular weight of Garcinone B?
The molecular weight of Garcinone B is 394.14 g/mol.
Where can I buy Garcinone B?
You can request a quote for Garcinone B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Garcinone B?
Yes, KEHONG BIO provides custom synthesis services for Garcinone B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.