Bioactive Compound Details
| BioID | bio427 |
|---|---|
| Name | FEROTOCOTRIMER C |
| ChEMBL ID | CHEMBL228693 |
| Molecular Formula | C86H142O6 |
| Molecular Weight | 1272.08 |
| Molecular Weight (Monoisotopic) | 1271.0806 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar11 |
| Target Name | Proto-oncogene c-RAF (c-RAF) |
| Synonyms | Ferotocotrimer C |
| Smiles | CC1=C(C)[C@@]23Oc4c(C)c(C)c5c(c4C[C@@]2(CC[C@@](C)(CCCC(C)CCCC(C)CCCC(C)C)O3)C2(Cc3c4c(c(C)c(C)c3O2)O[C@](C)(CCCC(C)CCCC(C)CCCC(C)C)CC4)C1=O)CC[C@@](C)(CCCC(C)CCCC(C)CCCC(C)C)O5 |
| Inchi | InChI=1S/C86H142O6/c1-57(2)31-22-34-60(7)37-25-40-63(10)43-28-48-81(19)51-46-72-74-55-84-54-53-83(21,50-30-45-65(12)42-27-39-62(9)36-24-33-59(5)6)92-86(84,91-79(74)69(16)67(14)76(72)88-81)71(18)70(17)80(87)85(84)56-75-73-47-52-82(20,89-77(73)66(13)68(15)78(75)90-85)49-29-44-64(11)41-26-38-61(8)35-23-32-58(3)4/h57-65H,22-56H2,1-21H3/t60?,61?,62?,63?,64?,65?,81-,82-,83-,84+,85?,86+/m1/s1 |
| Inchi Key | XGVMASJYFHMXGH-KMGDASETSA-N |
| Molecular Species | None |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | None |
| Records Key | ['5'] |
| Records Name | ['ferotocotrimer C'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
