Bioactive Compound Details
| BioID | bio273 |
|---|---|
| Name | swiholide C |
| ChEMBL ID | CHEMBL504982 |
| Molecular Formula | C77H132O20 |
| Molecular Weight | 1377.88 |
| Molecular Weight (Monoisotopic) | 1376.9312 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | swiholide C |
| Smiles | CO[C@H]1C[C@H](CC[C@H](C)[C@H](O)[C@H](C)[C@H]2OC(=O)/C=C/C(C)=C/C[C@H](O)C[C@@H]3CCC[C@H](C[C@H](OC)[C@@H](C)[C@@H](O)C[C@@H](O)[C@H](C)[C@@H]([C@@H](C)[C@@H](O)[C@@H](C)CC[C@H]4C[C@H](O)C[C@H](C)O4)OC(=O)/C=C/C(C)=C/C[C@H](O)C[C@@H]4C=CC[C@H](C[C@H](OC)[C@@H](C)[C@@H](O)C[C@@H](O)[C@@H]2C)O4)O3)O[C@@H](C)C1 |
| Inchi | InChI=1S/C77H132O20/c1-44-22-28-56(78)36-59-19-17-21-62(95-59)41-71(91-15)51(8)67(82)43-69(84)53(10)77(55(12)75(88)47(4)27-31-64-39-65(89-13)35-49(6)93-64)97-73(86)33-25-45(2)23-29-57(79)37-60-18-16-20-61(94-60)40-70(90-14)50(7)66(81)42-68(83)52(9)76(96-72(85)32-24-44)54(11)74(87)46(3)26-30-63-38-58(80)34-48(5)92-63/h17,19,22-25,32-33,46-71,74-84,87-88H,16,18,20-21,26-31,34-43H2,1-15H3/b32-24+,33-25+,44-22+,45-23+/t46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58+,59-,60-,61+,62+,63-,64-,65+,66-,67-,68+,69+,70-,71-,74-,75-,76-,77-/m0/s1 |
| Inchi Key | SMEYYVWHJIDVPC-BRDVWWKGSA-N |
| Molecular Species | None |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | None |
| Records Key | ['17'] |
| Records Name | ['swiholide C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
