Mangostinone
TL;DR: Mangostinone (CAS 166197-40-6) is a chemical compound with molecular formula C23H24O5 and molecular weight 380.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5-trihydroxyxanthen-9-one
Also Known As: mangostinone, 2-geranyl-1,3,5-trihydroxyxanthone, J1.912.229H, 2-[(2E)-3,7-DIMETHYLOCTA-2,6-DIEN-1-YL]-1,3,5-TRIHYDROXY-9H-XANTHEN-9-ONE, 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5-trihydroxyxanthen-9-one
| Molecular Formula | C23H24O5 |
|---|---|
| Molecular Weight | 380.16 g/mol |
| LogP | 5.2982 |
| Topological Polar Surface Area | 90.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 380.16238 |
| Heavy Atoms | 28 |
| Complexity | 1161.2732 |
Chemical Identifiers
| CAS Number | 166197-40-6 |
|---|---|
| SMILES | CC(=CCC/C(=C/CC1=C(C2=C(C=C1O)OC3=C(C2=O)C=CC=C3O)O)/C)C |
Product Overview
Mangostinone (CAS 166197-40-6), with molecular formula C23H24O5 and molecular weight 380.16 g/mol. IUPAC: 2-[(2E)-3,7-dimethylocta-2,6-dienyl]-1,3,5-trihydroxyxanthen-9-one.
Chemical Property Profile of Mangostinone
Property Insights of Mangostinone
The XLogP value of 5.2982 indicates that Mangostinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Mangostinone. Following Lipinski's Rule of Five, Mangostinone has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mangostinone?
The CAS number of Mangostinone is 166197-40-6.
What is the molecular formula of Mangostinone?
The molecular formula of Mangostinone is C23H24O5.
What is the molecular weight of Mangostinone?
The molecular weight of Mangostinone is 380.16 g/mol.
Where can I buy Mangostinone?
You can request a quote for Mangostinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mangostinone?
Yes, KEHONG BIO provides custom synthesis services for Mangostinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.