Vitas-M small molecule compound
{2-[4-(acetyloxy)phenyl]-7-methyl-1,3-dioxo-1,2,3,3a,7,7a-hexahydro-4H-4,7-epoxyisoindol-4-yl}methanediyl diacetate
Catalog ID
STL387281
SMILES CC(=O)Oc1ccc(cc1)N1C(=O)C2C(C1=O)C1(OC2(C)C=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/c1-11(24)29-15-7-5-14(6-8-15)23-18(27)16-17(19(23)28)22(10-9-21(16,4)32-22)20(30-12(2)25)31-13(3)26/h5-10,16-17,20H,1-4H3InChIKey
MWDJUKCLWRCKSS-UHFFFAOYSA-NSynonyms
(2(4(acetyloxy)phenyl)7methyl13dioxo1233a77ahexahydro4H47epoxyisoindol4yl)methanediyldiacetate
(4(4(diacetyloxymethyl)7methyl13dioxo3a7adihydrooctahydro1H47epoxyisoindol2yl)phenyl)acetate
CC(=O)OC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C4(C=CC3(O4)C)C(OC(=O)C)OC(=O)C
InChI=1SC22H21NO9c111(24)29157514(6815)2318(27)1617(19(23)28)22(10921(164)3222)20(3012(2)25)3113(3)26h510161720H14H3
MFCD04309035
ZINC000227057148
ZINC000227057167
Check stock
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Check stock on Vitas-MAvailable files
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