Bioactive Compound Details
| BioID | bio377 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL445948 |
| Molecular Formula | C48H70N8O13 |
| Molecular Weight | 967.13 |
| Molecular Weight (Monoisotopic) | 966.5062 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | 7-Azidokabiramide C |
| Smiles | CO[C@H]([C@H](C)/C=C/N(C)C=O)[C@@H](C)C(=O)CC[C@H](C)[C@@H](C[C@@H]1OC(=O)CC(OC(N)=O)C[C@H](C)C[C@@H](N=[N+]=[N-])[C@H](C)[C@@H](OC)c2coc(n2)-c2coc(n2)-c2coc(n2)/C=C/C[C@H](OC)[C@H]1C)OC |
| Inchi | InChI=1S/C48H70N8O13/c1-27-19-33(68-48(49)60)21-43(59)69-41(22-40(62-9)28(2)15-16-38(58)31(5)44(63-10)29(3)17-18-56(7)26-57)32(6)39(61-8)13-12-14-42-51-36(24-65-42)46-53-37(25-67-46)47-52-35(23-66-47)45(64-11)30(4)34(20-27)54-55-50/h12,14,17-18,23-34,39-41,44-45H,13,15-16,19-22H2,1-11H3,(H2,49,60)/b14-12+,18-17+/t27-,28-,29+,30-,31-,32+,33?,34+,39-,40+,41-,44+,45+/m0/s1 |
| Inchi Key | BHXAESJLWINUJJ-UBIQIYAUSA-N |
| Molecular Species | ACID |
| Targets | 2.0 |
| Bioactivities | 6.0 |
| Np Likeness Score | 1.06 |
| Records Key | ['2'] |
| Records Name | ['7-Azidokabiramide C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
