| BioID | bio198814 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL255085 |
|---|
| Molecular Formula | C25H28O4 |
|---|
| Molecular Weight | 392.5 |
|---|
| Molecular Weight (Monoisotopic) | 392.1988 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | (1' R,2' S,6' R)-2-Hydroxyisopanduratin A |
|---|
| Smiles | CC(C)=CC[C@@H]1C(C)=CC[C@@H](C(=O)c2c(O)cc(O)cc2O)[C@@H]1c1ccccc1 |
|---|
| Inchi | InChI=1S/C25H28O4/c1-15(2)9-11-19-16(3)10-12-20(23(19)17-7-5-4-6-8-17)25(29)24-21(27)13-18(26)14-22(24)28/h4-10,13-14,19-20,23,26-28H,11-12H2,1-3H3/t19-,20-,23-/m1/s1 |
|---|
| Inchi Key | WKJOSDIVVPRKTB-TXTKFYIRSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 1.0 |
|---|
| Np Likeness Score | 1.78 |
|---|
| Records Key | ['3'] |
|---|
| Records Name | [(1' R,2' S,6' R)-2-hydroxyisopanduratin A"]" |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
