Vitas-M small molecule compound

propyl (3aS,6R,7aR)-2-(2-methylpropyl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate

Catalog ID
STL564203
SMILES CCCOC(=O)C1[C@@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)CC(C)C)O2

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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 C16H23NO4 MW 293.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23NO4/c1-4-7-20-15(19)12-11-5-6-16(21-11)9-17(8-10(2)3)14(18)13(12)16/h5-6,10-13H,4,7-9H2,1-3H3/t11-,12?,13+,16-/m1/s1
InChIKey
RMGHDQQSBLJBMT-HCYBMXRASA-N
Synonyms
1214625-69-0
(3aS6R7aR)propyl2isobutyl1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
1214625690
17577464
CCCOC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)CC(C)C)O2
InChI=1SC16H23NO4c1472015(19)12115616(2111)917(810(2)3)14(18)13(12)16h561013H479H213H3t1112?13+16m1s1
MFCD03662171
propyl(1S5R7R)3(2methylpropyl)4oxo10oxa3azatricyclo(521015)dec8ene6carboxylate
propyl(3aS6R7aR)2(2methylpropyl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
ZINC000002235981
ZINC000002235982

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Available files

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