Type: | Approved drug |
PubChem: | 6437065 |
DrugBank: | DB01253 |
IUPAC: | (6aR,9R)-N-[(2S)-1-hydroxypropan-2-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(Z)-2-butenedioic acid |
Standard InChI: | InChI=1S/C19H23N3O2.C4H4O4/c1-11(10-23)21-19(24)13-6-15-14-4-3-5-16-18(14)12(8-20-16)7-17(15)22(2)9-13;5-3(6)1-2-4(7)8/h3-6,8,11,13,17,20,23H,7,9-10H2,1-2H3,(H,21,24);1-2H,(H,5,6)(H,7,8)/b;2-1-/t11-,13+,17+;/m0./s1 |
Standard InChIKey: | YREISLCRUMOYAY-IIPCNOPRSA-N |
SMILES: | CC(CO)NC(=O)C1C=C2C3=CC=CC4=C3C(=C[NH]4)CC2N(C)C1.O=C(O)C=CC(=O)O |
Metabolism-related information: | No data |
Reference: | No data |
Chemical Structure | Metablite's name | Reaction name | Genus | Species | Reference |
---|---|---|---|---|---|
None | Unknown | Unknown | Gut microbiota | Gut microbiota | 10.1038/s41586-019-1291-3 |