Vitas-M small molecule compound
4',4'-dimethyl-6a,7,8,9,10,11-hexahydro-2'H,5H,6'H-spiro[azepino[1,2-a]quinoline-6,1'-cyclohexane]-2',6'-dione
Catalog ID
STL448416
SMILES O=C1CC(C)(C)CC(=O)C21Cc1ccccc1N1C2CCCCC1
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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 C21H27NO2 MW 325.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27NO2/c1-20(2)13-18(23)21(19(24)14-20)12-15-8-5-6-9-16(15)22-11-7-3-4-10-17(21)22/h5-6,8-9,17H,3-4,7,10-14H2,1-2H3InChIKey
GEKXVQFGDVLGGF-UHFFFAOYSA-NSynonyms
44dimethyl6a7891011hexahydro2H5H6Hspiro(azepino(12a)quinoline61cyclohexane)26dione
55dimethylspiro(6a7891011hexahydro5Hazepino(12a)quinoline62cyclohexane)13dione
CC1(CC(=O)C2(CC3=CC=CC=C3N4C2CCCCC4)C(=O)C1)C
InChI=1SC21H27NO2c120(2)1318(23)21(19(24)1420)1215856916(15)22117341017(21)22h568917H3471014H212H3
MFCD07773848
ZINC000004913961
ZINC000004913974
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