Trypacidin
methyl 4,5'-dimethoxy-6-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate
Also Known As: Trypacidin|EX-A16381|HB4116|HY-N10255|methyl 4,5'-dimethoxy-6-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate|(-)-4,6/'-Dimethoxy-6-methyl-3,4/'-dioxospiro[benzofuran-2(3H),1/'-[2,5]cyclohexadiene]-2/'-carboxyl|Spiro(benzofuran-2(3H),1'-(2,5)cyclohexadiene)-2'-carboxylic acid, 4,6'-dimethoxy-6-methyl-3,4'-dioxo-, methyl ester, (-)-|(-)-4,6'-Dimethoxy-6-methyl-3,4'-dioxospiro[benzofuran-2(3H),1'-[2,5]cyclohexadiene]-2'-carboxylic acid methyl ester|(-)-4,6 -Dimethoxy-6-methyl-3,4 -dioxospiro[benzofuran-2(3H),1 -[2,5]cyclohexadiene]-2 -carboxylic acid methyl ester|methyl 2',4-dimethoxy-6-methyl-3,4'-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohexane]-2',5'-diene-6'-carboxylate|methyl 4,5'-dimethoxy-6-methyl-3,3'-dioxo-spiro[benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate|methyl 4,5'-dimethoxy-6-methyl-3,3'-dioxospiro(1-benzofuran-2,6'-cyclohexa-1,4-diene)-1'-carboxylate|Methyl 4,6'-dimethoxy-6-methyl-3,4'-dioxo-3H-spiro[[1]benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate|Methyl 4,6'-dimethoxy-6-methyl-3,4'-dioxo-3H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-2'-carboxylate
| Molecular Formula | C18H16O7 |
|---|---|
| Molecular Weight | 344.0896 g/mol |
| LogP | 1.52992 |
| Topological Polar Surface Area | 88.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.0896 |
| Monoisotopic Mass | 344.0896 |
| Heavy Atoms | 25 |
| Complexity | 862.4207 |
Chemical Identifiers
| CAS Number | 1900-29-4 |
|---|---|
| SMILES | CC1=CC2=C(C(=C1)OC)C(=O)C3(O2)C(=CC(=O)C=C3OC)C(=O)OC |
Product Overview
Trypacidin (CAS 1900-29-4), with molecular formula C18H16O7 and molecular weight 344.0896 g/mol. IUPAC: methyl 4,5'-dimethoxy-6-methyl-3,3'-dioxospiro[1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate.