| BioID | bio197685 |
|---|
| Name | PLAKORSTATIN 2 |
|---|
| ChEMBL ID | CHEMBL506384 |
|---|
| Molecular Formula | C19H32O5 |
|---|
| Molecular Weight | 340.46 |
|---|
| Molecular Weight (Monoisotopic) | 340.225 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | Plakorstatin 2 |
|---|
| Smiles | CC/C(=C\[C@@]1(CC)C[C@H](CC)[C@H](CC(=O)OC)OO1)[C@@H]1O[C@@H]1CC |
|---|
| Inchi | InChI=1S/C19H32O5/c1-6-13-11-19(9-4,24-23-16(13)10-17(20)21-5)12-14(7-2)18-15(8-3)22-18/h12-13,15-16,18H,6-11H2,1-5H3/b14-12+/t13-,15+,16-,18-,19+/m0/s1 |
|---|
| Inchi Key | CFXNHQNIKKFEDQ-SIQOOVPDSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 7.0 |
|---|
| Bioactivities | 8.0 |
|---|
| Np Likeness Score | 2.67 |
|---|
| Records Key | ['2, 9R,10R or 9S,10S', '92'] |
|---|
| Records Name | ['plakorstatin 2', 'plakorstatin 2'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
