Bioactive Compound Details
| BioID | bio911 |
|---|---|
| Name | ULONGAMIDE C |
| ChEMBL ID | CHEMBL451852 |
| Molecular Formula | C36H45N5O7S |
| Molecular Weight | 691.85 |
| Molecular Weight (Monoisotopic) | 691.304 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Ulongamide C |
| Smiles | CCC[C@H]1NC(=O)c2csc(n2)[C@H](C)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](Cc2ccc(O)cc2)N(C)C(=O)[C@H](C)OC(=O)[C@@H]1C |
| Inchi | InChI=1S/C36H45N5O7S/c1-7-11-27-21(2)36(47)48-23(4)34(45)41(6)30(19-25-14-16-26(42)17-15-25)35(46)40(5)29(18-24-12-9-8-10-13-24)32(44)37-22(3)33-39-28(20-49-33)31(43)38-27/h8-10,12-17,20-23,27,29-30,42H,7,11,18-19H2,1-6H3,(H,37,44)(H,38,43)/t21-,22+,23+,27-,29+,30+/m1/s1 |
| Inchi Key | PETFICLABWDIHU-OTYHWCEUSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 1.21 |
| Records Key | ['3'] |
| Records Name | ['Ulongamide C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
