| BioID | bio395 |
|---|
| Name | MONODICTYSIN C |
|---|
| ChEMBL ID | CHEMBL376473 |
|---|
| Molecular Formula | C16H20O6 |
|---|
| Molecular Weight | 308.33 |
|---|
| Molecular Weight (Monoisotopic) | 308.126 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | monodictysin C |
|---|
| Smiles | COc1cc(O)c2c(c1)O[C@]1(C)[C@@H](O)[C@@H](C)C[C@H](O)[C@@H]1C2=O |
|---|
| Inchi | InChI=1S/C16H20O6/c1-7-4-10(18)13-14(19)12-9(17)5-8(21-3)6-11(12)22-16(13,2)15(7)20/h5-7,10,13,15,17-18,20H,4H2,1-3H3/t7-,10-,13+,15-,16-/m0/s1 |
|---|
| Inchi Key | PIJNYABFKNAKHE-YZKPXJPOSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 6.0 |
|---|
| Bioactivities | 8.0 |
|---|
| Np Likeness Score | 2.55 |
|---|
| Records Key | ['3, monodictysin C'] |
|---|
| Records Name | ['(1S,3S,4S,4aS,9aS)-1,4,8-trihydroxy-6-methoxy-3,4a-dimethyl-1,2,3,4,4a,9a-hexahydro-9H-xanthen-9-one'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
