Vitas-M small molecule compound
2-(5-acetyl-2-ethoxyphenyl)-4,7-dimethyl-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
Catalog ID
STL387201
SMILES CCOc1ccc(cc1N1C(=O)C2C(C1=O)C1(OC2(C)C=C1)C)C(=O)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 C20H21NO5 MW 355.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO5/c1-5-25-14-7-6-12(11(2)22)10-13(14)21-17(23)15-16(18(21)24)20(4)9-8-19(15,3)26-20/h6-10,15-16H,5H2,1-4H3InChIKey
DMZFHWXMPCRDFN-UHFFFAOYSA-NSynonyms
2(5acetyl2ethoxyphenyl)47dimethyl3a477atetrahydro1H47epoxyisoindole13(2H)dione
2(5acetyl2ethoxyphenyl)47dimethyl3a7adihydrooctahydro1H47epoxyisoindole13dione
CCOC1=C(C=C(C=C1)C(=O)C)N2C(=O)C3C(C2=O)C4(C=CC3(O4)C)C
InChI=1SC20H21NO5c1525147612(11(2)22)1013(14)2117(23)1516(18(21)24)20(4)9819(153)2620h6101516H5H214H3
MFCD02316001
ZINC000226627920
ZINC000226627934
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