A1MB9
Summary
| Name: | 2-(2-hydroxyphenyl)-8-methoxy-3,5,7-tris(oxidanyl)chromen-4-one |
| Formula: | C16 H12 O7 |
| Formal charge: | 0 |
| Formula weight: | 316.262 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 2-(2-hydroxyphenyl)-8-methoxy-3,5,7-tris(oxidanyl)chromen-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H12O7/c1-22-15-10(19)6-9(18)11-12(20)13(21)14(23-16(11)15)7-4-2-3-5-8(7)17/h2-6,17-19,21H,1H3 |
| InChIKey | InChI | 1.06 | ULWRDCUZFLPUAB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1c(O)cc(O)c2C(=O)C(=C(Oc12)c3ccccc3O)O |
| SMILES | CACTVS | 3.385 | COc1c(O)cc(O)c2C(=O)C(=C(Oc12)c3ccccc3O)O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1c(cc(c2c1OC(=C(C2=O)O)c3ccccc3O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1c(cc(c2c1OC(=C(C2=O)O)c3ccccc3O)O)O |
