Bioactive Compound Details
| BioID | bio197460 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL1173679 |
| Molecular Formula | C26H33NO6 |
| Molecular Weight | 455.55 |
| Molecular Weight (Monoisotopic) | 455.2308 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 1,2-Bis(2-Methylbutyryl)Lycorine |
| Smiles | CCC(C)C(=O)O[C@H]1[C@H]2c3cc4c(cc3CN3CCC(=C[C@@H]1OC(=O)C(C)CC)[C@H]23)OCO4 |
| Inchi | InChI=1S/C26H33NO6/c1-5-14(3)25(28)32-21-9-16-7-8-27-12-17-10-19-20(31-13-30-19)11-18(17)22(23(16)27)24(21)33-26(29)15(4)6-2/h9-11,14-15,21-24H,5-8,12-13H2,1-4H3/t14?,15?,21-,22-,23+,24+/m0/s1 |
| Inchi Key | LRCDFTNMLRRTAG-APUHXJDDSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 1.76 |
| Records Key | ['4'] |
| Records Name | ['1,2-Bis(2-methylbutyryl)lycorine'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
