| BioID | bio507 |
|---|
| Name | GARCIHOMBRONANES C |
|---|
| ChEMBL ID | CHEMBL511954 |
|---|
| Molecular Formula | C31H48O4 |
|---|
| Molecular Weight | 484.72 |
|---|
| Molecular Weight (Monoisotopic) | 484.3553 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Garcihombronanes C |
|---|
| Smiles | COC(=O)/C(C)=C/[C@H](O)C[C@@H](C)[C@]1(C)CC=C2C3=C(CC[C@]21C)[C@@]1(C)CC[C@@H](O)C(C)(C)[C@@H]1CC3 |
|---|
| Inchi | InChI=1S/C31H48O4/c1-19(27(34)35-8)17-21(32)18-20(2)30(6)15-12-24-22-9-10-25-28(3,4)26(33)13-14-29(25,5)23(22)11-16-31(24,30)7/h12,17,20-21,25-26,32-33H,9-11,13-16,18H2,1-8H3/b19-17+/t20-,21+,25+,26-,29-,30+,31-/m1/s1 |
|---|
| Inchi Key | DSRXFFLSYVPYKU-NVHZQPCMSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 4.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | 3.36 |
|---|
| Records Key | ['1', '7'] |
|---|
| Records Name | ['(4R,6R)-methyl 4-hydroxy-6-((3R,5R,10S,13S,17S)-3-hydroxy-4,4,10,13,17-pentamethyl-2,3,4,5,6,7,10,11,12,13,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylhept-2-enoate', 'garcihombronanes C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
