Bioactive Compound Details
| BioID | bio615 |
|---|---|
| Name | MALEVAMIDE C |
| ChEMBL ID | CHEMBL453513 |
| Molecular Formula | C79H125N13O16 |
| Molecular Weight | 1512.94 |
| Molecular Weight (Monoisotopic) | 1511.9367 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Malevamide C |
| Smiles | C#CCCCC1NC(=O)[C@H]([C@@H](C)CC)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C)NC(=O)[C@@H](C)N(C)C(=O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](COC)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@@H]2CCCN2C(=O)[C@H](C)NC(=O)[C@H](C(C)C)OC(=O)C1C |
| Inchi | InChI=1S/C79H125N13O16/c1-23-25-27-35-55-50(12)79(106)108-65(48(9)10)69(96)81-52(14)71(98)90-39-30-36-57(90)73(100)88(20)63(47(7)8)78(105)86(18)61(44-107-22)76(103)85(17)60(43-54-33-28-26-29-34-54)75(102)84(16)53(15)66(93)80-51(13)70(97)87(19)62(46(5)6)67(94)83-56(42-45(3)4)72(99)91-40-32-38-59(91)77(104)92-41-31-37-58(92)74(101)89(21)64(49(11)24-2)68(95)82-55/h1,26,28-29,33-34,45-53,55-65H,24-25,27,30-32,35-44H2,2-22H3,(H,80,93)(H,81,96)(H,82,95)(H,83,94)/t49-,50?,51-,52-,53+,55?,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-/m0/s1 |
| Inchi Key | AJYHEKJFCQXDSB-NDIISJRKSA-N |
| Molecular Species | None |
| Targets | 3.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | None |
| Records Key | ['3'] |
| Records Name | ['malevamide C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
