Vitas-M small molecule compound
pentyl (3aS,6R,7aR)-2-(naphthalen-1-yl)-1-oxo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole-7-carboxylate
Catalog ID
STL537557
SMILES CCCCCOC(=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 C24H25NO4 MW 391.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO4/c1-2-3-6-14-28-23(27)20-19-12-13-24(29-19)15-25(22(26)21(20)24)18-11-7-9-16-8-4-5-10-17(16)18/h4-5,7-13,19-21H,2-3,6,14-15H2,1H3/t19-,20?,21+,24-/m1/s1InChIKey
MIJGALVNUOMISF-LYUBYTMKSA-NSynonyms
957019-29-3(3aS6R7aR)pentyl2(naphthalen1yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
16398419
957019293
CCCCCOC(=O)C1(C@H)2C=C(C@@)3((C@@H)1C(=O)N(C3)c1cccc3c1cccc3)O2
InChI=1SC24H25NO4c1236142823(27)2019121324(2919)1525(22(26)21(20)24)181179168451017(16)18h457131921H2361415H21H3t1920?21+24m1s1
MFCD03662100
pentyl(1~(S)5~(R)7~(R))3naphthalen1yl4oxo10oxa3azatricyclo(5210^(15))dec8ene6carboxylate
pentyl(3aS6R7aR)2(naphthalen1yl)1oxo123677ahexahydro3a6epoxyisoindole7carboxylate
ZINC000002145783
ZINC000002145784
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