| BioID | bio198187 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL516707 |
|---|
| Molecular Formula | C18H19NO5 |
|---|
| Molecular Weight | 329.35 |
|---|
| Molecular Weight (Monoisotopic) | 329.1263 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-O-Acetyllycorine |
|---|
| Smiles | CC(=O)O[C@H]1C=C2CCN3Cc4cc5c(cc4[C@H]([C@@H]1O)[C@@H]23)OCO5 |
|---|
| Inchi | InChI=1S/C18H19NO5/c1-9(20)24-15-4-10-2-3-19-7-11-5-13-14(23-8-22-13)6-12(11)16(17(10)19)18(15)21/h4-6,15-18,21H,2-3,7-8H2,1H3/t15-,16-,17+,18+/m0/s1 |
|---|
| Inchi Key | VDUHVXXNLXFPLR-WNRNVDISSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 11.0 |
|---|
| Bioactivities | 17.0 |
|---|
| Np Likeness Score | 2.41 |
|---|
| Records Key | ['6', '5, lycorine chlorohydrin', '17'] |
|---|
| Records Name | ['2-O-Acetyllycorine', '(1S,2S,12bS,12cS)-1,2-Diol-2,4,5,7,12b,12c-hexahydro-1H-[1,3]dioxolo[4,5-j]pyrrolo[3,2,1-de]phenanthridine-2-acetate', '2-O-Acetyllycorine'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
