Vitas-M small molecule compound
8-acetyl-10-(2-hydroxy-6-methoxyquinolin-3-yl)-2-methyl-6,7,8,10-tetrahydropyrrolo[3',4':6,7]azepino[4,3,2-cd]indol-9(2H)-one
Catalog ID
STL549591
SMILES COc1ccc2c(c1)cc(c(n2)O)C1C2=C(CN(C2=O)C(=O)C)Nc2c3c1cn(c3ccc2)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 C26H22N4O4 MW 454.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N4O4/c1-13(31)30-12-20-24(26(30)33)22(17-11-29(2)21-6-4-5-19(27-20)23(17)21)16-10-14-9-15(34-3)7-8-18(14)28-25(16)32/h4-11,22,27H,12H2,1-3H3,(H,28,32)InChIKey
CJPOUMNACOWUPE-UHFFFAOYSA-NSynonyms
127252839
5acetyl8(6methoxy2oxo1~(H)quinolin3yl)11methyl2511triazatetracyclo(7610^(37)0^(1216))hexadeca1(16)3(7)91214pentaen6one
8acetyl10(2hydroxy6methoxyquinolin3yl)2methyl67810tetrahydropyrrolo(3467)azepino(432cd)indol9(2H)one
InChI=1SC26H22N4O4c113(31)30122024(26(30)33)22(171129(2)2164519(2720)23(17)21)161014915(343)7818(14)2825(16)32h4112227H12H213H3(H2832)
MFCD31757076
ZINC000604404106
ZINC000604404110
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