| BioID | bio639 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL499510 |
|---|
| Molecular Formula | C35H64O7 |
|---|
| Molecular Weight | 596.89 |
|---|
| Molecular Weight (Monoisotopic) | 596.4652 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar11 |
|---|
| Target Name | Proto-oncogene c-RAF (c-RAF) |
|---|
| Synonyms | (2,4-Cis/Trans)-Squamoxinone C |
|---|
| Smiles | CCCCCCCCCC[C@H](O)[C@H]1CC[C@H]([C@H](O)CCCCCC(O)CCCCCCC2CC(CC(C)=O)C(=O)O2)O1 |
|---|
| Inchi | InChI=1S/C35H64O7/c1-3-4-5-6-7-8-9-16-21-31(38)33-23-24-34(42-33)32(39)22-17-12-14-19-29(37)18-13-10-11-15-20-30-26-28(25-27(2)36)35(40)41-30/h28-34,37-39H,3-26H2,1-2H3/t28?,29?,30?,31-,32+,33+,34+/m0/s1 |
|---|
| Inchi Key | OSJHMIVGKCXWHH-ZAKUOXEKSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 7.0 |
|---|
| Bioactivities | 7.0 |
|---|
| Np Likeness Score | 1.58 |
|---|
| Records Key | ['(2,4-cis/trans)-squamoxinone C'] |
|---|
| Records Name | ['(2,4-cis/trans)-squamoxinone C'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
