R0U
Summary
| Name: | 3-(4-hydroxyphenyl)-6-methoxy-5,7-bis(oxidanyl)chromen-4-one |
| Synonyms: | tectorigenin |
| Formula: | C16 H12 O6 |
| Formal charge: | 0 |
| Formula weight: | 300.263 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-(4-hydroxyphenyl)-6-methoxy-5,7-bis(oxidanyl)chromen-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H12O6/c1-21-16-11(18)6-12-13(15(16)20)14(19)10(7-22-12)8-2-4-9(17)5-3-8/h2-7,17-18,20H,1H3 |
| InChIKey | InChI | 1.06 | OBBCRPUNCUPUOS-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1c(O)cc2OC=C(C(=O)c2c1O)c3ccc(O)cc3 |
| SMILES | CACTVS | 3.385 | COc1c(O)cc2OC=C(C(=O)c2c1O)c3ccc(O)cc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1c(cc2c(c1O)C(=O)C(=CO2)c3ccc(cc3)O)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1c(cc2c(c1O)C(=O)C(=CO2)c3ccc(cc3)O)O |
