Vitas-M small molecule compound
[2-(3-acetylphenyl)-7-methyl-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl]methanediyl diacetate
Catalog ID
STK257621
SMILES CC(=O)OC(C12C=CC(O1)(C1C2C(=O)N(C1=O)c1cccc(c1)C(=O)C)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 C22H21NO8 MW 427.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO8/c1-11(24)14-6-5-7-15(10-14)23-18(27)16-17(19(23)28)22(9-8-21(16,4)31-22)20(29-12(2)25)30-13(3)26/h5-10,16-17,20H,1-4H3InChIKey
PNMGKNIZLDIVSS-UHFFFAOYSA-NSynonyms
(2(3acetylphenyl)7methyl13dioxo1233a77ahexahydro4H47epoxyisoindol4yl)methanediyldiacetate
(acetyloxy(2(3acetylphenyl)7methyl13dioxo3a7adihydrooctahydro1H47epoxyisoindol4yl)methyl)acetate
CC(=O)C1=CC(=CC=C1)N2C(=O)C3C(C2=O)C4(C=CC3(O4)C)C(OC(=O)C)OC(=O)C
InChI=1SC22H21NO8c111(24)1465715(1014)2318(27)1617(19(23)28)22(9821(164)3122)20(2912(2)25)3013(3)26h510161720H14H3
MFCD04309358
ZINC000001102265
ZINC000239174210
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