| PDB CCD ID: | C5E |
| Number of entries in BioLiP: | 8 |
| Chemical formula: | C11 H14 N2 O |
| InChI: | InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2/t8-,9+/m0/s1 |
| InChIKey: | ANJTVLIZGCUXLD-DTWKUNHWSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.7.6 | C1[C@H]2CNC[C@@H]1C3=CC=CC(=O)N3C2 | | ACDLabs 12.01 | O=C1C=CC=C2N1CC3CNCC2C3 | | CACTVS 3.370 | O=C1C=CC=C2[CH]3CNC[CH](C3)CN12 | | OpenEye OEToolkits 1.7.6 | C1C2CNCC1C3=CC=CC(=O)N3C2 | | CACTVS 3.370 | O=C1C=CC=C2[C@H]3CNC[C@H](C3)CN12 |
|
| Name: | (1R,5S)-1,2,3,4,5,6-HEXAHYDRO-8H-1,5-METHANOPYRIDO[1,2-A][1,5]DIAZOCIN-8-ONE;
CYTISINE |
| ChEMBL: | CHEMBL497939 |
| DrugBank: | DB09028 |
| ZINC: | ZINC000001599730 |
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