Vitas-M small molecule compound
2-(4-methoxyphenyl)-2-oxoethyl 2-(1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl)benzoate
Catalog ID
STK268783
SMILES COc1ccc(cc1)C(=O)COC(=O)c1ccccc1N1C(=O)C2C(C1=O)C1CC2C=C1
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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 C25H21NO6 MW 431.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO6/c1-31-17-10-8-14(9-11-17)20(27)13-32-25(30)18-4-2-3-5-19(18)26-23(28)21-15-6-7-16(12-15)22(21)24(26)29/h2-11,15-16,21-22H,12-13H2,1H3InChIKey
BOAAEOARFPUVPO-UHFFFAOYSA-NSynonyms
2(4methoxyphenyl)2oxoethyl2(13dioxo133a477ahexahydro2H47methanoisoindol2yl)benzoate
COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2N3C(=O)C4C5CC(C4C3=O)C=C5
InChI=1SC25H21NO6c1311710814(91117)20(27)133225(30)18423519(18)2623(28)21156716(1215)22(21)24(26)29h21115162122H1213H21H3
MFCD01362185
ZINC000100552463
ZINC000101154332
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