Vitas-M small molecule compound

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

Catalog ID
STL006626
SMILES COC(=O)C1[C@@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)C1CCCC1)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 C15H19NO4 MW 277.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19NO4/c1-19-14(18)11-10-6-7-15(20-10)8-16(13(17)12(11)15)9-4-2-3-5-9/h6-7,9-12H,2-5,8H2,1H3/t10-,11?,12+,15-/m1/s1
InChIKey
XLKNNCVAHJBTJB-GSNLGQFWSA-N
Synonyms
1212427-38-7
(3aS6R7aR)methyl2cyclopentyl1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
1212427387
COC(=O)C1(C@@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)C1CCCC1)O2
COC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)C1CCCC1)O2
methyl(3aS6R7aR)2cyclopentyl1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
MFCD18247151
ZINC000000543269
ZINC000000543270

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.