Vitas-M small molecule compound
ethyl 3-[1,3-dioxo-5-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,3-dihydro-2H-isoindol-2-yl]benzoate
Catalog ID
STL503605
SMILES CCOC(=O)c1cccc(c1)N1C(=O)c2c(C1=O)cc(cc2)C12CC3CC(C2)CC(C1)C3
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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 C27H27NO4 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27NO4/c1-2-32-26(31)19-4-3-5-21(11-19)28-24(29)22-7-6-20(12-23(22)25(28)30)27-13-16-8-17(14-27)10-18(9-16)15-27/h3-7,11-12,16-18H,2,8-10,13-15H2,1H3InChIKey
RBFUGOAIFLYACW-UHFFFAOYSA-NSynonyms
126843789
ethyl3(13dioxo5(tricyclo(3311~37~)dec1yl)13dihydro2Hisoindol2yl)benzoate
ethyl3(5(1adamantyl)13dioxoisoindol2yl)benzoate
InChI=1SC27H27NO4c123226(31)1943521(1119)2824(29)227620(1223(22)25(28)30)271316817(1427)1018(916)1527h3711121618H28101315H21H3
MFCD31538485
ZINC000670417839
ZINC670417839
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