| BioID | bio92 |
|---|
| Name | ALTISSIMACOUMARIN C |
|---|
| ChEMBL ID | CHEMBL2071525 |
|---|
| Molecular Formula | C21H28O7 |
|---|
| Molecular Weight | 392.45 |
|---|
| Molecular Weight (Monoisotopic) | 392.1835 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | Altissimacoumarin C |
|---|
| Smiles | COc1cc2ccc(=O)oc2c(OC)c1OC[C@@H](O)[C@](C)(O)CCC=C(C)C |
|---|
| Inchi | InChI=1S/C21H28O7/c1-13(2)7-6-10-21(3,24)16(22)12-27-19-15(25-4)11-14-8-9-17(23)28-18(14)20(19)26-5/h7-9,11,16,22,24H,6,10,12H2,1-5H3/t16-,21-/m1/s1 |
|---|
| Inchi Key | NIDLLNZZMATZKI-IIBYNOLFSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | 1.85 |
|---|
| Records Key | ['1, Altissimacoumarin C'] |
|---|
| Records Name | [(2'R,3'R)-7-(2',3'-dihydroxy-3',7'-dimethylocta-6'-enyloxy)-6,8-dimethoxycoumarin"]" |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
