Vitas-M small molecule compound
methyl 1-oxo-2-(1-phenylethyl)-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STK384155
SMILES COC(=O)C1C2C=CC3(C1C(=O)N(C3)C(c1ccccc1)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 C18H19NO4 MW 313.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19NO4/c1-11(12-6-4-3-5-7-12)19-10-18-9-8-13(23-18)14(17(21)22-2)15(18)16(19)20/h3-9,11,13-15H,10H2,1-2H3InChIKey
KNDMWRNUGYJRIY-UHFFFAOYSA-NSynonyms
(3aS6R7aR)methyl1oxo2(1phenylethyl)123677ahexahydro3a6epoxyisoindole7carboxylate
CC(C1=CC=CC=C1)N2CC34C=CC(O3)C(C4C2=O)C(=O)OC
COC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)C(c1ccccc1)C)O2
InChI=1SC18H19NO4c111(126435712)1910189813(2318)14(17(21)222)15(18)16(19)20h39111315H10H212H3
methyl1oxo2(1phenylethyl)123677ahexahydro3a6epoxyisoindole7carboxylate
MFCD03828314
ZINC000141935387
ZINC000239331359
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