Bioactive Compound Details
| BioID | bio231 |
|---|---|
| Name | PICRASINOSIDE C |
| ChEMBL ID | CHEMBL455293 |
| Molecular Formula | C28H42O11 |
| Molecular Weight | 554.63 |
| Molecular Weight (Monoisotopic) | 554.2727 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Picrasinoside C |
| Smiles | COC1=C[C@@H](C)C2C[C@H]3O[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C[C@H]4[C@@H](C)[C@@H]5OCO[C@H]5[C@@H]([C@@]34C)[C@@]2(C)C1=O |
| Inchi | InChI=1S/C28H42O11/c1-11-6-15(34-5)25(33)28(4)13(11)7-17-27(3)14(12(2)22-23(24(27)28)36-10-35-22)8-18(38-17)39-26-21(32)20(31)19(30)16(9-29)37-26/h6,11-14,16-24,26,29-32H,7-10H2,1-5H3/t11-,12-,13?,14+,16-,17-,18+,19-,20+,21-,22+,23-,24+,26+,27-,28+/m1/s1 |
| Inchi Key | OXASTUFERDOEDO-BLLJQZPCSA-N |
| Molecular Species | NEUTRAL |
| Targets | 6.0 |
| Bioactivities | 6.0 |
| Np Likeness Score | 2.95 |
| Records Key | ['3'] |
| Records Name | ['Picrasinoside C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
