Vitas-M small molecule compound
ethyl 3-[4-(hydroxymethyl)-7-methyl-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl]benzoate
Catalog ID
STL384330
SMILES CCOC(=O)c1cccc(c1)N1C(=O)C2C(C1=O)C1(OC2(C)C=C1)CO
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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 C19H19NO6 MW 357.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO6/c1-3-25-17(24)11-5-4-6-12(9-11)20-15(22)13-14(16(20)23)19(10-21)8-7-18(13,2)26-19/h4-9,13-14,21H,3,10H2,1-2H3InChIKey
WKKAPEKUXJUAHC-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC(=CC=C1)N2C(=O)C3C(C2=O)C4(C=CC3(O4)C)CO
ethyl3(4(hydroxymethyl)7methyl13dioxo133a477ahexahydro2H47epoxyisoindol2yl)benzoate
ethyl3(4(hydroxymethyl)7methyl13dioxo3a7adihydrooctahydro1H47epoxyisoindol2yl)benzoate
InChI=1SC19H19NO6c132517(24)1154612(911)2015(22)1314(16(20)23)19(1021)8718(132)2619h49131421H310H212H3
MFCD03557405
ZINC000226628273
ZINC000226628292
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