Rocaglamide J
methyl 1,8b-dihydroxy-6,8-dimethoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxylate
| Molecular Formula | C28H28O8 |
|---|---|
| Molecular Weight | 492.5 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 104.0 A2 |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 492.1784 |
| Heavy Atoms | 36 |
| Complexity | 778.0 |
Chemical Identifiers
| CAS Number | 147059-47-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C23C(C(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C(=O)OC)C5=CC=CC=C5 |
| InChIKey | VFTGDXPPYSWBSO-UHFFFAOYSA-N |
📖 Product Overview
Rocaglamide J (CAS: 147059-47-0) is a chemical compound with molecular formula C28H28O8 and molecular weight 492.5 g/mol. Its IUPAC systematic name is methyl 1,8b-dihydroxy-6,8-dimethoxy-3a-(4-methoxyphenyl)-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxylate.
VFTGDXPPYSWBSO-UHFFFAOYSA-N.
SMILES: COC1=CC=C(C=C1)C23C(C(C(C2(C4=C(O3)C=C(C=C4OC)OC)O)O)C(=O)OC)C5=CC=CC=C5.
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