Bioactive Compound Details
| BioID | bio1606 |
|---|---|
| Name | FOMITOSIDE C |
| ChEMBL ID | CHEMBL510510 |
| Molecular Formula | C35H54O7 |
| Molecular Weight | 586.81 |
| Molecular Weight (Monoisotopic) | 586.387 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Fomitoside C |
| Smiles | CC(C)=CCC[C@@H](C(=O)O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1CC3 |
| Inchi | InChI=1S/C35H54O7/c1-20(2)9-8-10-21(30(40)42-31-29(39)28(38)25(36)19-41-31)22-13-17-35(7)24-11-12-26-32(3,4)27(37)15-16-33(26,5)23(24)14-18-34(22,35)6/h9,21-22,25-26,28-29,31,36,38-39H,8,10-19H2,1-7H3/t21-,22-,25-,26+,28+,29-,31+,33-,34-,35+/m1/s1 |
| Inchi Key | FTPANSKMWIDRLL-QDVPQEPLSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | 3.12 |
| Records Key | ['5, Fomitoside C'] |
| Records Name | ['3-oxolanosta-8,24-dien-21-oic acid 21-O-beta-D-xylopyranoside'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
