Vitas-M small molecule compound
3-[8-acetyl-9-hydroxy-2-(3-methylbutyl)-2,7,8,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-10-yl]-7-methoxy-1-methylquinolin-2(1H)-one
Catalog ID
STL545907
SMILES COc1ccc2c(c1)n(C)c(=O)c(c2)C1C2=C(O)N(CC2=Nc2c3c1cn(c3ccc2)CCC(C)C)C(=O)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C31H32N4O4 MW 524.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N4O4/c1-17(2)11-12-34-15-22-27(21-13-19-9-10-20(39-5)14-26(19)33(4)30(21)37)29-24(16-35(18(3)36)31(29)38)32-23-7-6-8-25(34)28(22)23/h6-10,13-15,17,27,38H,11-12,16H2,1-5H3InChIKey
HMZPNRNWASFVDO-UHFFFAOYSA-NSynonyms
3(8acetyl9hydroxy2(3methylbutyl)27810tetrahydropyrrolo(3467)azepino(432cd)indol10yl)7methoxy1methylquinolin2(1H)one
InChI=1SC31H32N4O4c117(2)111234152227(21131991020(395)1426(19)33(4)30(21)37)2924(1635(18(3)36)31(29)38)322376825(34)28(22)23h6101315172738H111216H215H3
MFCD31756317
ZINC000409415423
ZINC000409415424
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