Bioactive Compound Details
| BioID | bio1577 |
|---|---|
| Name | ITOL C |
| ChEMBL ID | CHEMBL2269144 |
| Molecular Formula | C20H32O7 |
| Molecular Weight | 384.47 |
| Molecular Weight (Monoisotopic) | 384.2148 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | None |
| Smiles | CC(C)[C@@]1(O)[C@H](O)[C@@H]2[C@@]3(O)[C@@H]4O[C@@](O)(C[C@@]2(C)[C@@]2(O)CC[C@](C)(O)[C@@H]42)[C@]31C |
| Inchi | InChI=1S/C20H32O7/c1-9(2)19(25)12(21)10-14(3)8-18(24)16(19,5)20(10,26)13(27-18)11-15(4,22)6-7-17(11,14)23/h9-13,21-26H,6-8H2,1-5H3/t10-,11+,12+,13+,14+,15-,16-,17+,18-,19+,20+/m0/s1 |
| Inchi Key | RTTRCBQMIVGVHU-MMGSHDRVSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 2.35 |
| Records Key | ['3'] |
| Records Name | ['Itol C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
