Bioactive Compound Details
| BioID | bio1664 |
|---|---|
| Name | AMPHIDINOLIDE C |
| ChEMBL ID | CHEMBL415892 |
| Molecular Formula | C41H62O10 |
| Molecular Weight | 714.94 |
| Molecular Weight (Monoisotopic) | 714.4343 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Amphidinolide C |
| Smiles | C=C1/C=C(\C)[C@@H](C)[C@@H](O)CC(=O)[C@@H](C)CC(=O)C[C@H]2CC[C@@H](O2)[C@H](/C=C/C=C(\C)[C@@H](O)C(=C)CCCC)OC(=O)C[C@@H]2O[C@H](C[C@H]2C)[C@H](O)[C@@H]1O |
| Inchi | InChI=1S/C41H62O10/c1-9-10-12-23(2)39(46)24(3)13-11-14-34-35-16-15-31(49-35)20-30(42)18-26(5)32(43)21-33(44)29(8)25(4)17-28(7)40(47)41(48)37-19-27(6)36(50-37)22-38(45)51-34/h11,13-14,17,26-27,29,31,33-37,39-41,44,46-48H,2,7,9-10,12,15-16,18-22H2,1,3-6,8H3/b14-11+,24-13+,25-17+/t26-,27+,29+,31+,33-,34-,35+,36-,37+,39-,40+,41-/m0/s1 |
| Inchi Key | RNKCEFQNDOJBLW-DFGXUIPVSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 2.0 |
| Records Key | ['4'] |
| Records Name | ['amphidinolide C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
