Vitas-M small molecule compound
(3aR,6aS)-3-(3,4-dimethoxyphenyl)-5-(2-methoxy-5-nitrophenyl)-3aH-pyrrolo[3,4-d][1,2]oxazole-4,6(5H,6aH)-dione
Catalog ID
STK543239
SMILES COc1cc(ccc1OC)C1=NO[C@H]2[C@@H]1C(=O)N(C2=O)c1cc(ccc1OC)[N+](=O)[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 C20H17N3O8 MW 427.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O8/c1-28-13-7-5-11(23(26)27)9-12(13)22-19(24)16-17(21-31-18(16)20(22)25)10-4-6-14(29-2)15(8-10)30-3/h4-9,16,18H,1-3H3/t16-,18+/m1/s1InChIKey
UWFOXJYVQARMGP-AEFFLSMTSA-NSynonyms
1212243-04-3(3aR6aS)3(34dimethoxyphenyl)5(2methoxy5nitrophenyl)3a6adihydropyrrolo(34d)(12)oxazole46dione
(3aR6aS)3(34dimethoxyphenyl)5(2methoxy5nitrophenyl)3aHpyrrolo(34d)(12)oxazole46(5H6aH)dione
(3aR6aS)3(34dimethoxyphenyl)5(2methoxy5nitrophenyl)3aHpyrrolo(34d)isoxazole46(5H6aH)dione
1212243043
COC1=C(C=C(C=C1)(N+)(=O)(O))N2C(=O)C3C(C2=O)ON=C3C4=CC(=C(C=C4)OC)OC
COc1cc(ccc1OC)C1=NO(C@H)2(C@@H)1C(=O)N(C2=O)c1cc(ccc1OC)(N+)(=O)(O)
InChI=1SC20H17N3O8c128137511(23(26)27)912(13)2219(24)1617(213118(16)20(22)25)104614(292)15(810)303h491618H13H3t1618+m1s1
MFCD18242061
ZINC000100831977
ZINC100831977
Check stock
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