Bioactive Compound Details
| BioID | bio944 |
|---|---|
| Name | BISTRAMIDE C |
| ChEMBL ID | CHEMBL446267 |
| Molecular Formula | C40H66N2O8 |
| Molecular Weight | 702.97 |
| Molecular Weight (Monoisotopic) | 702.4819 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Bistramide C |
| Smiles | C/C=C/C(=O)C[C@H]1CC[C@H](C)[C@H](CC(=O)NC[C@H](O)[C@H](C)C(=O)NCCC[C@H]2O[C@@]3(CCC[C@@H](CC[C@H](C)/C=C(\C)C(C)=O)O3)CC[C@@H]2C)O1 |
| Inchi | InChI=1S/C40H66N2O8/c1-8-11-32(44)23-34-17-15-27(3)37(48-34)24-38(46)42-25-35(45)30(6)39(47)41-21-10-13-36-28(4)18-20-40(50-36)19-9-12-33(49-40)16-14-26(2)22-29(5)31(7)43/h8,11,22,26-28,30,33-37,45H,9-10,12-21,23-25H2,1-7H3,(H,41,47)(H,42,46)/b11-8+,29-22+/t26-,27-,28-,30-,33-,34+,35-,36+,37-,40-/m0/s1 |
| Inchi Key | WFVNZHRELNLEFI-ZMEWJFTKSA-N |
| Molecular Species | NEUTRAL |
| Targets | 6.0 |
| Bioactivities | 7.0 |
| Np Likeness Score | 1.72 |
| Records Key | ['3, BST-C'] |
| Records Name | ['Bistramide C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
