Vitas-M small molecule compound
2-[2-(3,4-dimethoxyphenyl)ethyl]-8-(propan-2-ylidene)hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STK447040
SMILES COc1cc(CCN2C(=O)C3C(C2=O)C2C(=C(C)C)C3CC2)ccc1OC
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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 C22H27NO4 MW 369.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4/c1-12(2)18-14-6-7-15(18)20-19(14)21(24)23(22(20)25)10-9-13-5-8-16(26-3)17(11-13)27-4/h5,8,11,14-15,19-20H,6-7,9-10H2,1-4H3InChIKey
BPAKSIHVBSJWKO-UHFFFAOYSA-NSynonyms
2(2(34dimethoxyphenyl)ethyl)8(propan2ylidene)hexahydro1H47methanoisoindole13(2H)dione
CC(=C1C2CCC1C3C2C(=O)N(C3=O)CCC4=CC(=C(C=C4)OC)OC)C
InChI=1SC22H27NO4c112(2)18146715(18)2019(14)21(24)23(22(20)25)109135816(263)17(1113)274h581114151920H67910H214H3
MFCD02176123
ZINC000100629689
ZINC000101710021
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