Details of THALBADENSINE
| IUPAC | (12S,25S)-5,31-dimethoxy-11,26-dimethyl-2,18-dioxa-11,26-diazaheptacyclo[23.6.2.214,17.119,23.03,8.07,12.029,33]hexatriaconta-1(31),3(8),4,6,14(36),15,17(35),19,21,23(34),29,32-dodecaene-4,20-diol |
| Canonical Smiles | CN1CCC2=CC(=C3C=C2C1CC4=CC(=C(C=C4)O)OC5=CC=C(CC6C7=CC(=C(C(=C7CCN6C)O3)O)OC)C=C5)OC |
| Inchi | ZRNIZOULGIUTLR-VMPREFPWSA-N |
| PubChem ID | 181849 |
| Smiles | COc1cc2c3cc1Oc1c(O)c(OC)cc4c1CCN(C)C4Cc1ccc(cc1)Oc1cc(ccc1O)CC3N(C)CC2 |
ERROR opening https://cactus.nci.nih.gov/chemical/structure/COc1cc2c3cc1Oc1c%28O%29c%28OC%29cc4c1CCN%28C%29C4Cc1ccc%28cc1%29Oc1cc%28ccc1O%29CC3N%28C%29CC2/file?format=sdf&get3d=True -- COc1cc2c3cc1Oc1c%28O%29c%28OC%29cc4c1CCN%28C%29C4Cc1ccc%28cc1%29Oc1cc%28ccc1O%29CC3N%28C%29CC2 could not be loaded.
| Class | Isoquinoline alkaloids, Tetrahydroisoquinoline alkaloids |
| Super Class | Tyrosine alkaloids |
| Pathways | Alkaloids |