Bioactive Compound Details
| BioID | bio1624 |
|---|---|
| Name | MICROFOKIENOXANE C |
| ChEMBL ID | CHEMBL463794 |
| Molecular Formula | C30H48O4 |
| Molecular Weight | 472.71 |
| Molecular Weight (Monoisotopic) | 472.3553 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | microfokienoxane C |
| Smiles | C[C@H]1[C@H](C)CC[C@@]23CC[C@@]4(C)[C@]5(C)CC[C@@H]6[C@](C)(CC[C@H](O)[C@@]6(C)CO)[C@H]5CC(=O)[C@]4(OC2)[C@H]13 |
| Inchi | InChI=1S/C30H48O4/c1-18-7-12-29-14-13-28(6)27(5)11-8-20-25(3,10-9-22(32)26(20,4)16-31)21(27)15-23(33)30(28,34-17-29)24(29)19(18)2/h18-22,24,31-32H,7-17H2,1-6H3/t18-,19+,20-,21-,22+,24-,25+,26+,27-,28+,29-,30+/m1/s1 |
| Inchi Key | PTIQAACUMWJTON-YIZGAZDMSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 5.0 |
| Np Likeness Score | 3.14 |
| Records Key | ['3, microfokienoxane C'] |
| Records Name | ['13-beta,28-epoxy-3-beta,23-dihydroxyursan-12-one'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
