Bioactive Compound Details
| BioID | bio464 |
|---|---|
| Name | ZHANKUIC ACID C |
| ChEMBL ID | CHEMBL1644791 |
| Molecular Formula | C29H42O6 |
| Molecular Weight | 486.65 |
| Molecular Weight (Monoisotopic) | 486.2981 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Zhankuic Acid C |
| Smiles | C=C(CC[C@@H](C)[C@H]1CC[C@H]2C3=C(C(=O)[C@H](O)[C@]12C)[C@@]1(C)CC[C@@H](O)[C@@H](C)[C@@H]1CC3=O)C(C)C(=O)O |
| Inchi | InChI=1S/C29H42O6/c1-14(16(3)27(34)35)7-8-15(2)18-9-10-19-23-22(31)13-20-17(4)21(30)11-12-28(20,5)24(23)25(32)26(33)29(18,19)6/h15-21,26,30,33H,1,7-13H2,2-6H3,(H,34,35)/t15-,16?,17+,18-,19+,20+,21-,26+,28+,29-/m1/s1 |
| Inchi Key | LVFHKUZOQUATIE-NIQDNRFFSA-N |
| Molecular Species | ACID |
| Targets | 13.0 |
| Bioactivities | 36.0 |
| Np Likeness Score | 3.0 |
| Records Key | ['3, Zhankuic acid C', '13', '28', '6'] |
| Records Name | ['3alpha,12alpha-dihydroxy-4alpha-methylergosta-8,24(28)-dien-7,11-dione-26-oic acid', 'zhankuic acid C', 'Zhankuic acid C', 'zhankuic acid C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
