Vitas-M small molecule compound
ethyl 4-{4-[bis(acetyloxy)methyl]-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-epoxyisoindol-2-yl}benzoate
Catalog ID
STK260130
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)C2C(C1=O)C1(OC2C=C1)C(OC(=O)C)OC(=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 C22H21NO9 MW 443.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO9/c1-4-29-20(28)13-5-7-14(8-6-13)23-18(26)16-15-9-10-22(32-15,17(16)19(23)27)21(30-11(2)24)31-12(3)25/h5-10,15-17,21H,4H2,1-3H3InChIKey
BUQHFGFRUJETAR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C4C=CC(C3C2=O)(O4)C(OC(=O)C)OC(=O)C
ethyl4(4(bis(acetyloxy)methyl)13dioxo133a477ahexahydro2H47epoxyisoindol2yl)benzoate
ethyl4(7(diacetyloxymethyl)13dioxo47adihydro3aHoctahydro1H47epoxyisoindol2yl)benzoate
InChI=1SC22H21NO9c142920(28)135714(8613)2318(26)161591022(321517(16)19(23)27)21(3011(2)24)3112(3)25h510151721H4H213H3
MFCD00324605
ZINC000101357462
ZINC000101357466
Check stock
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Check stock on Vitas-MAvailable files
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