Vitas-M small molecule compound
ethyl (3aS,6R,7aR)-2-(3-methoxypropyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STL564161
SMILES COCCCN1C[C@@]23[C@H](C1=O)C([C@@H](O3)C=C2)C(=O)OCC
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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 C15H21NO5 MW 295.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21NO5/c1-3-20-14(18)11-10-5-6-15(21-10)9-16(7-4-8-19-2)13(17)12(11)15/h5-6,10-12H,3-4,7-9H2,1-2H3/t10-,11?,12+,15-/m1/s1InChIKey
NLUZJOIRSXXCLK-GSNLGQFWSA-NSynonyms
1164490-77-0(3aS6R7aR)ethyl2(3methoxypropyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
1164490770
5389710
COCCCN1C(C@@)23(C@H)(C1=O)C((C@H)(O3)C=C2)C(=O)OCC
ethyl(1S5R7R)3(3methoxypropyl)4oxo10oxa3azatricyclo(521015)dec8ene6carboxylate
ethyl(3aS6R7aR)2(3methoxypropyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
InChI=1SC15H21NO5c132014(18)11105615(2110)916(748192)13(17)12(11)15h561012H3479H212H3t1011?12+15m1s1
MFCD04156175
ZINC000002401394
ZINC000002401395
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