Vitas-M small molecule compound
butyl (3aS,6R,7aR)-2-(naphthalen-1-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STL540490
SMILES CCCCOC(=O)C1[C@@H]2C=C[C@@]3([C@@H]1C(=O)N(C3)c1cccc3c1cccc3)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 C23H23NO4 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO4/c1-2-3-13-27-22(26)19-18-11-12-23(28-18)14-24(21(25)20(19)23)17-10-6-8-15-7-4-5-9-16(15)17/h4-12,18-20H,2-3,13-14H2,1H3/t18-,19?,20+,23-/m1/s1InChIKey
KCVUSZRLWXLCLQ-KOLTXKIZSA-NSynonyms
956819-66-2(3aS6R7aR)butyl2(naphthalen1yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
16398371
956819662
butyl(1~(S)5~(R)7~(R))3naphthalen1yl4oxo10oxa3azatricyclo(5210^(15))dec8ene6carboxylate
butyl(3aS6R7aR)2(naphthalen1yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
CCCCOC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)c1cccc3c1cccc3)O2
InChI=1SC23H23NO4c123132722(26)1918111223(2818)1424(21(25)20(19)23)17106815745916(15)17h4121820H231314H21H3t1819?20+23m1s1
MFCD03661893
ZINC000002091345
ZINC000002091348
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