| BioID | bio414 |
|---|
| Name | COCHINCHINENIN C |
|---|
| ChEMBL ID | CHEMBL254649 |
|---|
| Molecular Formula | C33H34O7 |
|---|
| Molecular Weight | 542.63 |
|---|
| Molecular Weight (Monoisotopic) | 542.2305 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | cochinchinenin C |
|---|
| Smiles | COc1ccc(C(CCc2ccc(O)cc2OC)c2cc(CCC(=O)c3ccc(O)cc3)c(OC)cc2O)cc1 |
|---|
| Inchi | InChI=1S/C33H34O7/c1-38-27-14-7-21(8-15-27)28(16-9-23-6-13-26(35)19-32(23)39-2)29-18-24(33(40-3)20-31(29)37)10-17-30(36)22-4-11-25(34)12-5-22/h4-8,11-15,18-20,28,34-35,37H,9-10,16-17H2,1-3H3 |
|---|
| Inchi Key | SLJWKFROLINAGW-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 4.0 |
|---|
| Bioactivities | 19.0 |
|---|
| Np Likeness Score | 0.49 |
|---|
| Records Key | ['7, cochinchinenin C', 'cc'] |
|---|
| Records Name | ['1-[5-(2-methoxy-4,4-dihydroxydihydrochalconyl)]-1-(4-methoxyphenyl)-3-(2-methoxy-4-hydroxyphenyl)propane', 'cochinchinenin C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
