Bioactive Compound Details
| BioID | bio965 |
|---|---|
| Name | CHISIAMOL C |
| ChEMBL ID | CHEMBL1668620 |
| Molecular Formula | C34H54O7 |
| Molecular Weight | 574.8 |
| Molecular Weight (Monoisotopic) | 574.387 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Chisiamol C |
| Smiles | CC(=O)O[C@@H]1CC[C@]2(C)[C@H]3CC[C@]4(C)C(=CC[C@@H]4[C@H]4COC(C)(C)[C@@H](O)[C@H](O)C4)[C@]3(C)[C@H](OC(C)=O)C[C@H]2C1(C)C |
| Inchi | InChI=1S/C34H54O7/c1-19(35)40-27-13-15-33(8)25-12-14-32(7)22(21-16-23(37)29(38)31(5,6)39-18-21)10-11-24(32)34(25,9)28(41-20(2)36)17-26(33)30(27,3)4/h11,21-23,25-29,37-38H,10,12-18H2,1-9H3/t21-,22-,23-,25-,26+,27-,28-,29+,32+,33-,34+/m1/s1 |
| Inchi Key | OTTULKBJOIKGDJ-SSYPYUHNSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 3.01 |
| Records Key | ['20'] |
| Records Name | ['Chisiamol C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
