Bioactive Compound Details
| BioID | bio1478 |
|---|---|
| Name | GRANAXYLOCARPIN C |
| ChEMBL ID | CHEMBL388137 |
| Molecular Formula | C32H40O11 |
| Molecular Weight | 600.66 |
| Molecular Weight (Monoisotopic) | 600.2571 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | 14Alpha-Hydroxyxyloccensin L |
| Smiles | C/C=C(\C)C(=O)O[C@@H]1[C@@H]2[C@H]3O[C@@]34[C@H](CC[C@@]3(C)[C@H](c5ccoc5)OC(=O)C[C@@]43O)[C@]3(C)[C@@H](CC(=O)OC)[C@]1(C)CO[C@]23O |
| Inchi | InChI=1S/C32H40O11/c1-7-16(2)26(35)42-24-22-25-31(43-25)18(29(5)19(12-20(33)38-6)27(24,3)15-40-32(22,29)37)8-10-28(4)23(17-9-11-39-14-17)41-21(34)13-30(28,31)36/h7,9,11,14,18-19,22-25,36-37H,8,10,12-13,15H2,1-6H3/b16-7+/t18-,19+,22-,23+,24-,25-,27+,28+,29-,30+,31+,32-/m1/s1 |
| Inchi Key | ULTXGWVTQCMLGB-ZGOOYMAXSA-N |
| Molecular Species | NEUTRAL |
| Targets | 2.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 3.19 |
| Records Key | ['3, granaxylocarpin C'] |
| Records Name | ['14alpha-hydroxyxyloccensin L'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
