Vitas-M small molecule compound
2-(2,5-dimethylphenyl)-2-oxoethyl 3-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK376679
SMILES Cc1ccc(c(c1)C(=O)COC(=O)c1cccc(c1)N1C(=O)C2C(C1=O)C1CC2C=C1)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 C26H23NO5 MW 429.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23NO5/c1-14-6-7-15(2)20(10-14)21(28)13-32-26(31)18-4-3-5-19(12-18)27-24(29)22-16-8-9-17(11-16)23(22)25(27)30/h3-10,12,16-17,22-23H,11,13H2,1-2H3InChIKey
GAEPJJNTDQBPND-UHFFFAOYSA-NSynonyms
2(25dimethylphenyl)2oxoethyl3(13dioxo133a477ahexahydro2H47methanoisoindol2yl)benzoate
CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC(=CC=C2)N3C(=O)C4C5CC(C4C3=O)C=C5
InChI=1SC26H23NO5c1146715(2)20(1014)21(28)133226(31)1843519(1218)2724(29)22168917(1116)23(22)25(27)30h3101216172223H1113H212H3
MFCD01362352
ZINC000100560989
ZINC000101154377
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