57D
Summary
| Name: | chrysin |
| Synonyms: | 5,7-dihydroxy-2-phenyl-4H-chromen-4-one |
| Formula: | C15 H10 O4 |
| Formal charge: | 0 |
| Formula weight: | 254.237 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 5,7-dihydroxy-2-phenyl-4H-chromen-4-one |
| OpenEye OEToolkits | 1.5.0 | 5,7-dihydroxy-2-phenyl-chromen-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1c3c(OC(=C1)c2ccccc2)cc(O)cc3O |
| SMILES_CANONICAL | CACTVS | 3.341 | Oc1cc(O)c2C(=O)C=C(Oc2c1)c3ccccc3 |
| SMILES | CACTVS | 3.341 | Oc1cc(O)c2C(=O)C=C(Oc2c1)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C2=CC(=O)c3c(cc(cc3O2)O)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)C2=CC(=O)c3c(cc(cc3O2)O)O |
| InChI | InChI | 1.03 | InChI=1S/C15H10O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-8,16-17H |
| InChIKey | InChI | 1.03 | RTIXKCRFFJGDFG-UHFFFAOYSA-N |
