Bioactive Compound Details
| BioID | bio145 |
|---|---|
| Name | DIDYMELLAMIDE C |
| ChEMBL ID | CHEMBL2333095 |
| Molecular Formula | C24H29NO5 |
| Molecular Weight | 411.5 |
| Molecular Weight (Monoisotopic) | 411.2046 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Didymellamide C |
| Smiles | C[C@@H]1CC[C@H]2[C@H](C(=O)c3c(O)c(C4(O)C=CC(=O)CC4)c[nH]c3=O)[C@H](C)C=C[C@@H]2C1 |
| Inchi | InChI=1S/C24H29NO5/c1-13-3-6-17-15(11-13)5-4-14(2)19(17)22(28)20-21(27)18(12-25-23(20)29)24(30)9-7-16(26)8-10-24/h4-5,7,9,12-15,17,19,30H,3,6,8,10-11H2,1-2H3,(H2,25,27,29)/t13-,14-,15-,17-,19-,24?/m1/s1 |
| Inchi Key | JKXALCZFBIKVEQ-ZOJOTGHDSA-N |
| Molecular Species | NEUTRAL |
| Targets | 3.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | 2.25 |
| Records Key | ['3'] |
| Records Name | ['Didymellamide C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
