| BioID | bio942 |
|---|
| Name | PECTINOLIDE C |
|---|
| ChEMBL ID | CHEMBL458475 |
|---|
| Molecular Formula | C14H20O5 |
|---|
| Molecular Weight | 268.31 |
|---|
| Molecular Weight (Monoisotopic) | 268.1311 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Pectinolide C |
|---|
| Smiles | CCCC[C@@H](/C=C\[C@@H]1OC(=O)C=C[C@@H]1O)OC(C)=O |
|---|
| Inchi | InChI=1S/C14H20O5/c1-3-4-5-11(18-10(2)15)6-8-13-12(16)7-9-14(17)19-13/h6-9,11-13,16H,3-5H2,1-2H3/b8-6-/t11-,12-,13-/m0/s1 |
|---|
| Inchi Key | DYWKRIWLCNEWRY-SHYGTOARSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 16.0 |
|---|
| Bioactivities | 24.0 |
|---|
| Np Likeness Score | 3.07 |
|---|
| Records Key | ['3', '3'] |
|---|
| Records Name | ['Pectinolide C', 'Pectinolide C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
