Bioactive Compound Details
| BioID | bio549 |
|---|---|
| Name | ANANOSIC ACID C |
| ChEMBL ID | CHEMBL469852 |
| Molecular Formula | C30H44O3 |
| Molecular Weight | 452.68 |
| Molecular Weight (Monoisotopic) | 452.329 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Ananosic acid C |
| Smiles | C=C1C[C@H]2C(=CC[C@H]3C(C)(C)C(=O)CC[C@]23C)[C@]2(C)CC[C@H]([C@H](C)CC/C=C(/C)C(=O)O)C12 |
| Inchi | InChI=1S/C30H44O3/c1-18(9-8-10-19(2)27(32)33)21-13-15-30(7)22-11-12-24-28(4,5)25(31)14-16-29(24,6)23(22)17-20(3)26(21)30/h10-11,18,21,23-24,26H,3,8-9,12-17H2,1-2,4-7H3,(H,32,33)/b19-10-/t18-,21-,23+,24+,26?,29-,30+/m1/s1 |
| Inchi Key | XDDHMJIDSMQIEG-QVGLDXDQSA-N |
| Molecular Species | ACID |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 3.45 |
| Records Key | ['2, Ananosic acid C'] |
| Records Name | ['3-oxo-18-(13->12)-abeo-lanost-7(8),12(18),24(Z)-trien-26-oic acid'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
