Trematin
TL;DR: Trematin (CAS 2326-34-3) is a chemical compound with molecular formula C22H22O10 and molecular weight 446.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,7-dihydroxy-2-(4-methoxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
Also Known As: Trematin, Cytisoside, 4'-O-Methylvitexin, 2-(4-Methoxyphenyl)-8-(beta-D-glucopyranosyl)-5,7-dihydroxy-4H-1-benzopyran-4-one, 4H-1-Benzopyran-4-one, 8-.beta.-D-glucopyranosyl-5,7-dihydroxy-2-(4-methoxyphenyl)-
| Molecular Formula | C22H22O10 |
|---|---|
| Molecular Weight | 446.12 g/mol |
| LogP | 0.3947 |
| Topological Polar Surface Area | 170.05 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 446.1213 |
| Heavy Atoms | 32 |
| Complexity | 1184.0212 |
Chemical Identifiers
| CAS Number | 2326-34-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O |
Product Overview
Trematin (CAS 2326-34-3), with molecular formula C22H22O10 and molecular weight 446.12 g/mol. IUPAC: 5,7-dihydroxy-2-(4-methoxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one.
Chemical Property Profile of Trematin
Property Insights of Trematin
The XLogP value of 0.3947 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trematin. The TPSA of 170.05 Ų indicates high polarity, suggesting Trematin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Trematin has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Trematin?
The CAS number of Trematin is 2326-34-3.
What is the molecular formula of Trematin?
The molecular formula of Trematin is C22H22O10.
What is the molecular weight of Trematin?
The molecular weight of Trematin is 446.12 g/mol.
Where can I buy Trematin?
You can request a quote for Trematin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trematin?
Yes, KEHONG BIO provides custom synthesis services for Trematin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.