Retrojusticidin B
4-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-3H-benzo[f][2]benzofuran-1-one
Also Known As: Retrojusticidin B|4-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-3H-benzo[f][2]benzofuran-1-one|4-(2H-Benzo(3,4-d)1,3-dioxolan-5-yl)-6,7-dimethoxy-3-hydrobenzo(f)isobenzofuran-1-one|4-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-3H-benzo(f)(2)benzofuran-1-one|4-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-3H-benzo[f]isobenzofuran-1-one|4-(2H-1,3-Benzodioxol-5-yl)-6,7-dimethoxynaphtho[2,3-c]furan-1(3H)-one|4-Benzo[1,3]dioxol-5-yl-6,7-dimethoxy-3H-naphtho[2,3-c]furan-1-one|6,7-Dimethoxy-4-(1,3-benzodioxol-5-yl)naphtho[2,3-c]furan-1(3H)-one|4-(1,3-Benzodioxole-5-yl)-6,7-dimethoxy-1,3-dihydronaphtho[2,3-c]furan-1-one|4-(2H-1,3-BENZODIOXOL-5-YL)-6,7-DIMETHOXY-1H,3H-NAPHTHO[2,3-C]FURAN-1-ONE|4-(2H-Benzo[3,4-d]1,3-dioxolan-5-yl)-6,7-dimethoxy-3-hydrobenzo[f]isobenzofuran-1-one
| Molecular Formula | C21H16O6 |
|---|---|
| Molecular Weight | 364.0947 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.0947 |
| Monoisotopic Mass | 364.0947 |
| Heavy Atoms | 27 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 82001-16-9 |
|---|---|
| SMILES | COC1=CC2=CC3=C(COC3=O)C(=C2C=C1OC)C4=CC5=C(C=C4)OCO5 |
| InChIKey | TXDMVCNSUVLKHW-UHFFFAOYSA-N |
Product Overview
Retrojusticidin B (CAS 82001-16-9), with molecular formula C21H16O6 and molecular weight 364.0947 g/mol. IUPAC: 4-(1,3-benzodioxol-5-yl)-6,7-dimethoxy-3H-benzo[f][2]benzofuran-1-one.