| PDB CCD ID: | 3K8 |
| Number of entries in FURNA: | 2 |
| Chemical formula: | C24 H27 N O3 |
| InChI: | InChI=1S/C24H27NO3/c1-26-16-7-8-17-19(11-16)21-13-24(28-3)23(27-2)12-20(21)18-10-15-6-4-5-9-25(15)14-22(17)18/h7-8,11-13,15H,4-6,9-10,14H2,1-3H3/t15-/m1/s1 |
| InChIKey: | RSHYSOGXGSUUIJ-OAHLLOKOSA-N |
| SMILES: | COc1ccc2c(c1)c3cc(c(cc3c4c2CN5CCCCC5C4)OC)OC; COc1ccc2c(c1)c3cc(c(cc3c4c2CN5CCCC[C@@H]5C4)OC)OC; COc1ccc2c3CN4CCCC[C@@H]4Cc3c5cc(OC)c(OC)cc5c2c1; COc1ccc2c3CN4CCCC[CH]4Cc3c5cc(OC)c(OC)cc5c2c1; O(c2ccc1c5c(c3c(c1c2)cc(OC)c(OC)c3)CC4N(CCCC4)C5)C |
| Name: | (14aR)-2,3,6-trimethoxy-11,12,13,14,14a,15-hexahydro-9H-dibenzo[f,h]pyrido[1,2-b]isoquinoline; Cryptopleurine |
| ChEMBL: | CHEMBL198075 |
| ZINC: | ZINC000004098776 |
Reference: