Bioactive Compound Details
| BioID | bio810 |
|---|---|
| Name | FRUTICOSIDE C |
| ChEMBL ID | CHEMBL1782592 |
| Molecular Formula | C35H56O8 |
| Molecular Weight | 604.83 |
| Molecular Weight (Monoisotopic) | 604.3975 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Fruticoside C |
| Smiles | C=C(CC[C@@H](C(=O)O)[C@H]1CC[C@H]2C3=CC[C@H]4[C@H](C)[C@@H](O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@@H]5O)[C@H](O)C[C@]4(C)[C@H]3CC[C@]12C)C(C)C |
| Inchi | InChI=1S/C35H56O8/c1-17(2)18(3)8-9-22(32(40)41)25-13-12-24-21-10-11-23-19(4)31(43-33-30(39)29(38)28(37)20(5)42-33)27(36)16-35(23,7)26(21)14-15-34(24,25)6/h10,17,19-20,22-31,33,36-39H,3,8-9,11-16H2,1-2,4-7H3,(H,40,41)/t19-,20-,22+,23-,24-,25+,26-,27+,28-,29+,30-,31+,33-,34-,35-/m0/s1 |
| Inchi Key | BFCFMIFGAHEHCB-YOIAMOGFSA-N |
| Molecular Species | ACID |
| Targets | 5.0 |
| Bioactivities | 5.0 |
| Np Likeness Score | 3.09 |
| Records Key | ['4, Fruticoside C'] |
| Records Name | ['4alpha-methyl-2alpha-hydroxy-5alpha-ergost-7,24(28)-dien-21-oic acid-3beta-O-alpha-L-quinovopyranoside'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
