| BioID | bio522 |
|---|
| Name | CITRUSIN C |
|---|
| ChEMBL ID | CHEMBL463487 |
|---|
| Molecular Formula | C16H22O7 |
|---|
| Molecular Weight | 326.35 |
|---|
| Molecular Weight (Monoisotopic) | 326.1366 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Citrusin C|Eugenyl Beta-D-Glucopyranoside |
|---|
| Smiles | C=CCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(OC)c1 |
|---|
| Inchi | InChI=1S/C16H22O7/c1-3-4-9-5-6-10(11(7-9)21-2)22-16-15(20)14(19)13(18)12(8-17)23-16/h3,5-7,12-20H,1,4,8H2,2H3/t12-,13-,14+,15-,16-/m1/s1 |
|---|
| Inchi Key | VADSVXSGIFBZLI-IBEHDNSVSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 6.0 |
|---|
| Bioactivities | 9.0 |
|---|
| Np Likeness Score | 1.78 |
|---|
| Records Key | ['23', '4', 'Page no 269, R1C1', '13', '11', '22'] |
|---|
| Records Name | ['Citrusin C', 'eugenyl beta-D-glucopyranoside', 'eugenyl-4-O-beta-D-glucopyranoside', 'citrusin C', 'Eugenolglucoside', 'Citrusin C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
