InteriotherinA
TL;DR: InteriotherinA (CAS 181701-06-4) is a chemical compound with molecular formula C29H28O8 and molecular weight 504.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,22-dimethoxy-12,13-dimethyl-5,7,18,20-tetraoxapentacyclo[13.7.0.02,10.04,8.017,21]docosa-1(22),2,4(8),9,15,17(21)-hexaen-11-yl) benzoate
Also Known As: InteriotherinA, Interiotherin A, Interiotherins A, (-)-Interiotherin A, HY-N6849
| Molecular Formula | C29H28O8 |
|---|---|
| Molecular Weight | 504.18 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 504.1784 |
| Heavy Atoms | 37 |
| Complexity | 801.0 |
Chemical Identifiers
| CAS Number | 181701-06-4 |
|---|---|
| SMILES | CC1CC2=CC3=C(C(=C2C4=C(C5=C(C=C4C(C1C)OC(=O)C6=CC=CC=C6)OCO5)OC)OC)OCO3 |
| InChIKey | MBGKPRSARHEFAG-UHFFFAOYSA-N |
Product Overview
InteriotherinA (CAS 181701-06-4), with molecular formula C29H28O8 and molecular weight 504.18 g/mol. IUPAC: (3,22-dimethoxy-12,13-dimethyl-5,7,18,20-tetraoxapentacyclo[13.7.0.02,10.04,8.017,21]docosa-1(22),2,4(8),9,15,17(21)-hexaen-11-yl) benzoate.
Chemical Property Profile of InteriotherinA
Property Insights of InteriotherinA
The XLogP value of 6.1 indicates that InteriotherinA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for InteriotherinA. Following Lipinski's Rule of Five, InteriotherinA has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of InteriotherinA?
The CAS number of InteriotherinA is 181701-06-4.
What is the molecular formula of InteriotherinA?
The molecular formula of InteriotherinA is C29H28O8.
What is the molecular weight of InteriotherinA?
The molecular weight of InteriotherinA is 504.18 g/mol.
Where can I buy InteriotherinA?
You can request a quote for InteriotherinA directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for InteriotherinA?
Yes, KEHONG BIO provides custom synthesis services for InteriotherinA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.