Bioactive Compound Details
| BioID | bio559 |
|---|---|
| Name | CHAETOGLOBOSIN C |
| ChEMBL ID | CHEMBL502574 |
| Molecular Formula | C32H36N2O5 |
| Molecular Weight | 528.65 |
| Molecular Weight (Monoisotopic) | 528.2624 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Chaetoglobosin C |
| Smiles | C/C1=C\[C@@H](C)C/C=C/[C@H]2[C@@H]3O[C@]3(C)[C@@H](C)[C@H]3[C@H](Cc4c[nH]c5ccccc45)NC(=O)[C@]32C(=O)CCC(=O)C1=O |
| Inchi | InChI=1S/C32H36N2O5/c1-17-8-7-10-22-29-31(4,39-29)19(3)27-24(15-20-16-33-23-11-6-5-9-21(20)23)34-30(38)32(22,27)26(36)13-12-25(35)28(37)18(2)14-17/h5-7,9-11,14,16-17,19,22,24,27,29,33H,8,12-13,15H2,1-4H3,(H,34,38)/b10-7+,18-14+/t17-,19-,22-,24-,27-,29-,31+,32+/m0/s1 |
| Inchi Key | RIZAHVBYKWUPHQ-GNNSKLCBSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | 2.42 |
| Records Key | ['2', '4', 'Cheatoglobosin C'] |
| Records Name | ['Chaetoglobosin C', 'chaetoglobosin C', 'Cheatoglobosin C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
