Bioactive Compound Details
| BioID | bio1346 |
|---|---|
| Name | DESMETHOXYMAJUSCULAMIDE C |
| ChEMBL ID | CHEMBL538623 |
| Molecular Formula | C49H78N8O11 |
| Molecular Weight | 955.21 |
| Molecular Weight (Monoisotopic) | 954.579 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Desmethoxymajusculamide C |
| Smiles | CC[C@H](C)[C@@H]1OC(=O)[C@@H](C)[C@@H](CC)NC(=O)[C@H](C)NC(=O)C(C)(C)C(=O)[C@H](C)NC(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)CNC(=O)[C@H]([C@@H](C)CC)N(C)C(=O)CNC1=O |
| Inchi | InChI=1S/C49H78N8O11/c1-16-28(6)39-44(63)50-25-36(58)56(14)38(27(4)5)46(65)55(13)35(24-33-22-20-19-21-23-33)43(62)52-31(9)41(60)49(11,12)48(67)53-32(10)42(61)54-34(18-3)30(8)47(66)68-40(29(7)17-2)45(64)51-26-37(59)57(39)15/h19-23,27-32,34-35,38-40H,16-18,24-26H2,1-15H3,(H,50,63)(H,51,64)(H,52,62)(H,53,67)(H,54,61)/t28-,29-,30-,31-,32-,34+,35-,38-,39-,40-/m0/s1 |
| Inchi Key | FBFVXSBCWUNIQI-XPQZGKFDSA-N |
| Molecular Species | NEUTRAL |
| Targets | 7.0 |
| Bioactivities | 14.0 |
| Np Likeness Score | 1.12 |
| Records Key | ['1, cyclic DMMC'] |
| Records Name | ['Desmethoxymajusculamide C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
