Bioactive Compound Details
| BioID | bio1477 |
|---|---|
| Name | OBLONGANOSIDE C |
| ChEMBL ID | CHEMBL2269906 |
| Molecular Formula | C41H64O13 |
| Molecular Weight | 764.95 |
| Molecular Weight (Monoisotopic) | 764.4347 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | None |
| Smiles | CC1=C2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6OC[C@@H](O)[C@H](O)[C@H]6O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(=O)O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CC[C@H]1C |
| Inchi | InChI=1S/C41H64O13/c1-20-9-14-41(36(50)54-35-33(49)31(47)30(46)24(17-42)52-35)16-15-39(5)22(28(41)21(20)2)7-8-26-37(3)12-11-27(53-34-32(48)29(45)23(44)18-51-34)38(4,19-43)25(37)10-13-40(26,39)6/h7,20,23-27,29-35,42-49H,8-19H2,1-6H3/t20-,23-,24-,25-,26-,27+,29+,30-,31+,32-,33-,34+,35+,37+,38+,39-,40-,41+/m1/s1 |
| Inchi Key | SPUDUDKXAYSWJF-YNGDLQNLSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 2.54 |
| Records Key | ['6'] |
| Records Name | ['Oblonganoside C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
