Vitas-M small molecule compound
methyl 4-[5-(2-hydroxy-7,7-dimethyl-5-oxo-3,4,5,7-tetrahydrofuro[3,4-b]pyridin-4-yl)furan-2-yl]benzoate
Catalog ID
STL243979
SMILES COC(=O)c1ccc(cc1)c1ccc(o1)C1CC(=NC2=C1C(=O)OC2(C)C)O
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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 C21H19NO6 MW 381.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19NO6/c1-21(2)18-17(20(25)28-21)13(10-16(23)22-18)15-9-8-14(27-15)11-4-6-12(7-5-11)19(24)26-3/h4-9,13H,10H2,1-3H3,(H,22,23)InChIKey
QXUPCTHXNHGYJR-UHFFFAOYSA-NSynonyms
1324081-66-41324081664
CC1(C2=C(C(CC(=O)N2)C3=CC=C(O3)C4=CC=C(C=C4)C(=O)OC)C(=O)O1)C
InChI=1SC21H19NO6c121(2)1817(20(25)2821)13(1016(23)2218)159814(2715)114612(7511)19(24)263h4913H10H213H3(H2223)
methyl4(5(2hydroxy77dimethyl5oxo3457tetrahydrofuro(34b)pyridin4yl)furan2yl)benzoate
methyl4(5(77dimethyl25dioxo34dihydro1Hfuro(34b)pyridin4yl)furan2yl)benzoate
MFCD24859803
ZINC000101716147
ZINC000101716151
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