Vitas-M small molecule compound
dimethyl 4-(1,3-benzodioxol-5-yl)-1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK065632
SMILES COC(=O)C1=CN(C=C(C1c1ccc2c(c1)OCO2)C(=O)OC)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 C26H29NO6 MW 451.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO6/c1-30-24(28)19-12-27(26-9-15-5-16(10-26)7-17(6-15)11-26)13-20(25(29)31-2)23(19)18-3-4-21-22(8-18)33-14-32-21/h3-4,8,12-13,15-17,23H,5-7,9-11,14H2,1-2H3InChIKey
XGCPMBCVWZTODB-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=C(C1c1ccc2c(c1)OCO2)C(=O)OC)C12CC3CC(C2)CC(C1)C3
COC(=O)C1=CN(C=C(C1C2=CC3=C(C=C2)OCO3)C(=O)OC)C45CC6CC(C4)CC(C6)C5
DIMETHYL1(1ADAMANTYL)4(13BENZODIOXOL5YL)4HPYRIDINE35DICARBOXYLATE
dimethyl4(13benzodioxol5yl)1(tricyclo(3311~37~)dec1yl)14dihydropyridine35dicarboxylate
InChI=1SC26H29NO6c13024(28)191227(26915516(1026)717(615)1126)1320(25(29)312)23(19)18342122(818)33143221h3481213151723H5791114H212H3
MFCD03312396
STK065632
ZINC000004166295
ZINC04166295
ZINC4166295
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