Bioactive Compound Details
| BioID | bio199082 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL507545 |
| Molecular Formula | C20H20O7 |
| Molecular Weight | 372.37 |
| Molecular Weight (Monoisotopic) | 372.1209 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2',3'-Epoxyalkannin |
| Smiles | CC(C)=CC[C@H](OC(=O)C1OC1C)C1=CC(=O)c2c(O)ccc(O)c2C1=O |
| Inchi | InChI=1S/C20H20O7/c1-9(2)4-7-15(27-20(25)19-10(3)26-19)11-8-14(23)16-12(21)5-6-13(22)17(16)18(11)24/h4-6,8,10,15,19,21-22H,7H2,1-3H3/t10?,15-,19?/m0/s1 |
| Inchi Key | JFAQZHIETYMALG-XFTQQKOWSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 2.01 |
| Records Key | ['23'] |
| Records Name | [2',3'-Epoxyalkannin"]" |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
