3KD
(1S,2S,12bS,12cS)-2,4,5,7,12b,12c-hexahydro-1H-[1,3]dioxolo[4,5-j]pyrrolo[3,2,1-de]phenanthridine-1,2-diol
Find entries where: 3KD
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | (1S,2S,12bS,12cS)-2,4,5,7,12b,12c-hexahydro-1H-[1,3]dioxolo[4,5-j]pyrrolo[3,2,1-de]phenanthridine-1,2-diol |
| Identifiers | n/a |
| Formula | C16 H17 N O4 |
| Molecular Weight | 287.31 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1c2c(cc3c1OCO3)[C@@H]4[C@@H]([C@H](C=C5[C@H]4N(C2)CC5)O)O |
| InChI | InChI=1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h3-5,11,14-16,18-19H,1-2,6-7H2/t11-,14-,15+,16+/m0/s1 |
| InChIKey | XGVJWXAYKUHDOO-DANNLKNASA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 38 |
| Chiral Atom Count | 4 |
| Bond Count | 42 |
| Aromatic Bond Count | 6 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 72378 |
| ChEMBL | CHEMBL400092 |
| ChEBI | CHEBI:6601 |
| CCDC/CSD | LYCORN, LYCORN01 |
