Vitas-M small molecule compound
2-methylpropyl (3aS,6R,7aR)-2-(2-methylpropyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STL563020
SMILES CC(COC(=O)C1[C@@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)CC(C)C)O2)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 C17H25NO4 MW 307.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25NO4/c1-10(2)7-18-9-17-6-5-12(22-17)13(14(17)15(18)19)16(20)21-8-11(3)4/h5-6,10-14H,7-9H2,1-4H3/t12-,13?,14+,17-/m1/s1InChIKey
QJWRTSJSHIQCKG-XWEZZZMOSA-NSynonyms
956815-08-0(3aS6R7aR)isobutyl2isobutyl1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
16398409
2methylpropyl(1S5R7R)3(2methylpropyl)4oxo10oxa3azatricyclo(521015)dec8ene6carboxylate
2methylpropyl(3aS6R7aR)2(2methylpropyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
956815080
CC(COC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)CC(C)C)O2)C
InChI=1SC17H25NO4c110(2)7189176512(2217)13(14(17)15(18)19)16(20)21811(3)4h561014H79H214H3t1213?14+17m1s1
MFCD03662050
ZINC000004044163
ZINC000004044165
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