Bioactive Compound Details
| BioID | bio498 |
|---|---|
| Name | LATRUNCULOL C |
| ChEMBL ID | CHEMBL486344 |
| Molecular Formula | C22H33NO7S |
| Molecular Weight | 455.57 |
| Molecular Weight (Monoisotopic) | 455.1978 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Latrunculol C |
| Smiles | C/C1=C/C(=O)O[C@@H]2C[C@@H](CC[C@H](C)/C=C\[C@H](O)[C@H](O)CC1)O[C@@](O)([C@@H]1CSC(=O)N1)C2 |
| Inchi | InChI=1S/C22H33NO7S/c1-13-3-6-15-10-16(11-22(28,30-15)19-12-31-21(27)23-19)29-20(26)9-14(2)5-8-18(25)17(24)7-4-13/h4,7,9,13,15-19,24-25,28H,3,5-6,8,10-12H2,1-2H3,(H,23,27)/b7-4-,14-9-/t13-,15+,16+,17-,18+,19-,22+/m0/s1 |
| Inchi Key | JIGPCDTWTJZFFF-FLEVLNCLSA-N |
| Molecular Species | NEUTRAL |
| Targets | 3.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | 3.14 |
| Records Key | ['10'] |
| Records Name | ['Latrunculol C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
