Vitas-M small molecule compound
2-methylpropyl (3aS,6R,7aR)-2-(naphthalen-1-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STL547084
SMILES CC(COC(=O)C1[C@@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)c1cccc3c1cccc3)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 C23H23NO4 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO4/c1-14(2)12-27-22(26)19-18-10-11-23(28-18)13-24(21(25)20(19)23)17-9-5-7-15-6-3-4-8-16(15)17/h3-11,14,18-20H,12-13H2,1-2H3/t18-,19?,20+,23-/m1/s1InChIKey
LKEZNSDMWYWRIY-KOLTXKIZSA-NSynonyms
957004-32-9(3aS6R7aR)isobutyl2(naphthalen1yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
16398377
2methylpropyl(1~(S)5~(R)7~(R))3naphthalen1yl4oxo10oxa3azatricyclo(5210^(15))dec8ene6carboxylate
2methylpropyl(3aS6R7aR)2(naphthalen1yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
957004329
CC(COC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)c1cccc3c1cccc3)O2)C
InChI=1SC23H23NO4c114(2)122722(26)1918101123(2818)1324(21(25)20(19)23)1795715634816(15)17h311141820H1213H212H3t1819?20+23m1s1
MFCD03661914
ZINC000002091407
ZINC000002091409
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