Bioactive Compound Details
| BioID | bio1620 |
|---|---|
| Name | VISARTISIDE C |
| ChEMBL ID | CHEMBL1077014 |
| Molecular Formula | C35H36O16 |
| Molecular Weight | 712.66 |
| Molecular Weight (Monoisotopic) | 712.2003 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Visartiside C |
| Smiles | O=C(/C=C/c1ccccc1)OC[C@@]1(O)CO[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)c(O)c3)CC4=O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@@H]1O |
| Inchi | InChI=1S/C35H36O16/c36-14-26-29(42)30(43)31(51-34-32(44)35(45,16-47-34)15-46-27(41)9-6-17-4-2-1-3-5-17)33(50-26)48-19-11-22(39)28-23(40)13-24(49-25(28)12-19)18-7-8-20(37)21(38)10-18/h1-12,24,26,29-34,36-39,42-45H,13-16H2/b9-6+/t24-,26+,29+,30-,31+,32-,33+,34-,35+/m0/s1 |
| Inchi Key | DOVKRLBLJULZLC-DFROKGSNSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | 2.07 |
| Records Key | ['3, Visartiside C'] |
| Records Name | ['(2S)-naringenin 7-O-[5-O-transcinnamoyl-beta-D-apiosyl(1->2)]-beta-D-glucopyranoside'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
