Arnottin I
TL;DR: Arnottin I (CAS 64666-98-4) is a chemical compound with molecular formula C20H14O6 and molecular weight 350.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17,18-dimethoxy-5,7,21-trioxapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaen-20-one
Also Known As: Arnottin I, 17,18-dimethoxy-5,7,21-trioxapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaen-20-one, 2,3-(Methylenedioxy)-7,8-dimethoxy-6H-5-oxachrysene-6-one, 1,2-Dimethoxy-8,9-[methylenebis(oxy)]-12H-11-oxachrysene-12-one, 1,2-Dimethoxy-13H-benzo[d][1,3]dioxolo[6,7]naphtho[1,2-b]pyran-13-one
| Molecular Formula | C20H14O6 |
|---|---|
| Molecular Weight | 350.08 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 350.07904 |
| Heavy Atoms | 26 |
| Complexity | 552.0 |
Chemical Identifiers
| CAS Number | 64666-98-4 |
|---|---|
| SMILES | COC1=C(C2=C(C=C1)C3=C(C4=CC5=C(C=C4C=C3)OCO5)OC2=O)OC |
| InChIKey | AOYQXCYLRJFNFX-UHFFFAOYSA-N |
Product Overview
Arnottin I (CAS 64666-98-4), with molecular formula C20H14O6 and molecular weight 350.08 g/mol. IUPAC: 17,18-dimethoxy-5,7,21-trioxapentacyclo[11.8.0.02,10.04,8.014,19]henicosa-1(13),2,4(8),9,11,14(19),15,17-octaen-20-one.
Chemical Property Profile of Arnottin I
Property Insights of Arnottin I
The XLogP value of 4.0 indicates that Arnottin I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Arnottin I. Following Lipinski's Rule of Five, Arnottin I has 0 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 Arnottin I?
The CAS number of Arnottin I is 64666-98-4.
What is the molecular formula of Arnottin I?
The molecular formula of Arnottin I is C20H14O6.
What is the molecular weight of Arnottin I?
The molecular weight of Arnottin I is 350.08 g/mol.
Where can I buy Arnottin I?
You can request a quote for Arnottin I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Arnottin I?
Yes, KEHONG BIO provides custom synthesis services for Arnottin I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.