Vitas-M small molecule compound
dimethyl 4-(3-nitrophenyl)-1-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]-1,4-dihydropyridine-3,5-dicarboxylate
Catalog ID
STK767278
SMILES COC(=O)C1=CN(CCC23CC4CC(C3)CC(C2)C4)C=C(C1c1cccc(c1)[N+](=O)[O-])C(=O)OC
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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 C27H32N2O6 MW 480.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O6/c1-34-25(30)22-15-28(7-6-27-12-17-8-18(13-27)10-19(9-17)14-27)16-23(26(31)35-2)24(22)20-4-3-5-21(11-20)29(32)33/h3-5,11,15-19,24H,6-10,12-14H2,1-2H3InChIKey
NFYRVMSRIJCSFL-UHFFFAOYSA-NSynonyms
COC(=O)C1=CN(C=C(C1C2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC)CCC34CC5CC(C3)CC(C5)C4
COC(=O)C1=CN(CCC23CC4CC(C3)CC(C2)C4)C=C(C1c1cccc(c1)(N+)(=O)(O))C(=O)OC
DIMETHYL1(2(1ADAMANTYL)ETHYL)4(3NITROPHENYL)4HPYRIDINE35DICARBOXYLATE
dimethyl4(3nitrophenyl)1(2(tricyclo(3311~37~)dec1yl)ethyl)14dihydropyridine35dicarboxylate
InChI=1SC27H32N2O6c13425(30)221528(76271217818(1327)1019(917)1427)1623(26(31)352)24(22)2043521(1120)29(32)33h3511151924H6101214H212H3
MFCD03034382
ZINC000008867213
ZINC08867213
ZINC8867213
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