| BioID | bio993 |
|---|
| Name | DIHOMODEHYDROBATZELLADINE C |
|---|
| ChEMBL ID | CHEMBL1078458 |
|---|
| Molecular Formula | C29H51ClN6O2 |
|---|
| Molecular Weight | 551.22 |
|---|
| Molecular Weight (Monoisotopic) | 515.4068 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Dihomodehydrobatzelladine C |
|---|
| Smiles | CCCCCCCCC[C@@H]1C[C@@H]2CCc3c(C(=O)OCCCCNC(=N)N)c(CCCCC)nc([n+]32)N1.[Cl-] |
|---|
| Inchi | InChI=1S/C29H50N6O2.ClH/c1-3-5-7-8-9-10-12-15-22-21-23-17-18-25-26(27(36)37-20-14-13-19-32-28(30)31)24(16-11-6-4-2)34-29(33-22)35(23)25;/h22-23H,3-21H2,1-2H3,(H4,30,31,32);1H/t22-,23+;/m1./s1 |
|---|
| Inchi Key | SFLMULQHBGYHRM-RFPXDPOKSA-N |
|---|
| Molecular Species | BASE |
|---|
| Targets | 4.0 |
|---|
| Bioactivities | 10.0 |
|---|
| Np Likeness Score | 1.07 |
|---|
| Records Key | ['5'] |
|---|
| Records Name | ['dihomodehydrobatzelladine C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
