Details of Conophylline
| IUPAC | dimethyl 14,25-diethyl-24,33-dihydroxy-31,32-dimethoxy-12,22-dioxa-1,9,18,29-tetrazadodecacyclo[23.13.1.16,9.02,23.03,21.05,19.06,17.011,13.028,36.030,35.036,39.014,40]tetraconta-3,5(19),16,20,27,30,32,34-octaene-16,27-dicarboxylate |
| Canonical Smiles | CCC12CC(=C3C4(C1N(CC4)C5C(C2O)OC6=CC7=C(C=C56)C89CCN1C8C(CC(=C9N7)C(=O)OC)(C2C(C1)O2)CC)C1=CC(=C(C(=C1N3)OC)OC)O)C(=O)OC |
| Inchi | QZRIMAMDGWAHPQ-UHFFFAOYSA-N |
| PubChem ID | 9853848 |
| Smiles | CCC12CC(C(=O)OC)C3=Nc4cc5c(cc4C34CCN(CC3OC31)C42)C1C(O5)C(O)C2(CC)CC(C(=O)OC)C3=Nc4c(cc(O)c(OC)c4OC)C34CCN1C42 |
| Class | Aspidosperma type |
| Super Class | Tryptophan alkaloids |
| Pathways | Alkaloids |