Bioactive Compound Details
| BioID | bio199172 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1224756 |
| Molecular Formula | C21H18O6 |
| Molecular Weight | 366.37 |
| Molecular Weight (Monoisotopic) | 366.1103 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | (2'R)-4'-Hydroxyemoroidocarpan |
| Smiles | C=C(CO)[C@H]1Cc2cc3c(cc2O1)OC[C@H]1c2cc4c(cc2O[C@@H]31)OCO4 |
| Inchi | InChI=1S/C21H18O6/c1-10(7-22)15-3-11-2-13-17(5-16(11)26-15)23-8-14-12-4-19-20(25-9-24-19)6-18(12)27-21(13)14/h2,4-6,14-15,21-22H,1,3,7-9H2/t14-,15+,21-/m0/s1 |
| Inchi Key | KSESTLPJESZHFG-ZSDSOXJFSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 2.1 |
| Records Key | ['1', '18'] |
| Records Name | [(2'R)-4'-hydroxyemoroidocarpan", None]" |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
