Vitas-M small molecule compound
ethyl 4-[(3aS,6aR)-3-(2-methyl-2H-chromen-3-yl)-4,6-dioxo-3a,4,6,6a-tetrahydro-5H-pyrrolo[3,4-d][1,2]oxazol-5-yl]benzoate
Catalog ID
STK602739
SMILES CCOC(=O)c1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)C(=NO2)C1=Cc2ccccc2OC1C
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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 C24H20N2O6 MW 432.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20N2O6/c1-3-30-24(29)14-8-10-16(11-9-14)26-22(27)19-20(25-32-21(19)23(26)28)17-12-15-6-4-5-7-18(15)31-13(17)2/h4-13,19,21H,3H2,1-2H3/t13?,19-,21+/m0/s1InChIKey
MMNWRIGYIGYZRW-QMTGVFJSSA-NSynonyms
1013753-56-41013753564
CCOC(=O)C1=CC=C(C=C1)N2C(=O)C3C(C2=O)ON=C3C4=CC5=CC=CC=C5OC4C
CCOC(=O)c1ccc(cc1)N1C(=O)(C@H)2(C@@H)(C1=O)C(=NO2)C1=Cc2ccccc2OC1C
ethyl4((3aS6aR)3(2methyl2Hchromen3yl)46dioxo3a466atetrahydro5Hpyrrolo(34d)(12)oxazol5yl)benzoate
ethyl4((3aS6aR)3(2methyl2Hchromen3yl)46dioxo3a6adihydropyrrolo(34d)(12)oxazol5yl)benzoate
ethyl4((3aS6aR)3(2methyl2Hchromen3yl)46dioxo66adihydro3aHpyrrolo(34d)isoxazol5(4H)yl)benzoate
InChI=1SC24H20N2O6c133024(29)1481016(11914)2622(27)1920(253221(19)23(26)28)171215645718(15)3113(17)2h4131921H3H212H3t13?1921+m0s1
MFCD18246158
ZINC000009305772
ZINC000013627036
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