Bioactive Compound Details
| BioID | bio1358 |
|---|---|
| Name | CARUIFOLIN C |
| ChEMBL ID | CHEMBL506369 |
| Molecular Formula | C30H40O7 |
| Molecular Weight | 512.64 |
| Molecular Weight (Monoisotopic) | 512.2774 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Caruifolin C |
| Smiles | C=C1[C@@H](O)[C@@H]2[C@H]3[C@H](C(C)=C4[C@H]5OC(=O)[C@@H](C)[C@@H]5CC[C@](C)(O)[C@@H]43)[C@@]13[C@@H]2[C@@](C)(O)CC[C@H]1[C@H](C)C(=O)O[C@@H]13 |
| Inchi | InChI=1S/C30H40O7/c1-11-15-7-9-28(5,34)21-17(23(15)36-26(11)32)13(3)20-18(21)19-22(31)14(4)30(20)24(19)29(6,35)10-8-16-12(2)27(33)37-25(16)30/h11-12,15-16,18-25,31,34-35H,4,7-10H2,1-3,5-6H3/t11-,12-,15-,16-,18-,19-,20-,21-,22+,23-,24-,25-,28-,29-,30+/m0/s1 |
| Inchi Key | ZHXVHXSSXUYBOD-XTJXJPKUSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 2.7 |
| Records Key | ['4'] |
| Records Name | ['caruifolin C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
