3,3',4-Tri-O-methylellagic acid
6-hydroxy-7,13,14-trimethoxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
Also Known As: Combretum caffrum|2,3,8-Tri-O-methylellagic acid|3,7,8-Tri-O-methylellagic acid|3,3',4-tri-o-methylellagic acid|SureCN941424|3,3',4-O-Trimethylellagic acid|3,4,3'-Tri-O-methylellagic acid|2,3,8-Tri-O-methylellagicacid|3,3',4'-trimethylellagic acid|3,3',4-trimethyl ellagic acid|3,3',4'-Trimethoxyellagic acid|3,4,3 -Trimethylellagic acid|3,3',4'-trimethoxy-ellagic acid|HY-N1652|3,3',4'-tri-o-methylellagic acid|3,3 ,4-O-Trimethylellagic acid|NP4598|TN1203|ELLAGIC ACID, 3,3',4-TRI-O-METHYL|3,3 ,4-Tri-O-methylellagic acid|3,4,3 -Tri-O-methylellagic acid|Ellagic acid 3,3',4-trimethyl ether|Methyl1-methyl-1H-indole-2-carboxylate|ELLAGIC ACID,3',4-TRI-O-METHYL|4CN-1487|3,3 ,4 -Tri-O-methylellagic acid
| Molecular Formula | C17H12O8 |
|---|---|
| Molecular Weight | 344.05322 g/mol |
| LogP | 2.2218 |
| Topological Polar Surface Area | 108.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.05322 |
| Monoisotopic Mass | 344.05322 |
| Heavy Atoms | 25 |
| Complexity | 1247.5781 |
Chemical Identifiers
| CAS Number | 5145-53-9 |
|---|---|
| SMILES | COC1=C(C2=C3C(=C1)C(=O)OC4=C3C(=CC(=C4OC)O)C(=O)O2)OC |
Product Overview
3,3',4-Tri-O-methylellagic acid (CAS 5145-53-9), with molecular formula C17H12O8 and molecular weight 344.05322 g/mol. IUPAC: 6-hydroxy-7,13,14-trimethoxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione.
3,3',4-Tri-O-methylellagic acid is a custom synthesis product. We offer services from milligram to kilogram scale.
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