Vitas-M small molecule compound
methyl 3-butanoyl-4-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-6,6-dimethyl-2-oxocyclohex-3-ene-1-carboxylate
Catalog ID
STL524505
SMILES CCCC(=O)C1=C(NCCc2ccc(c(c2)OC)OC)CC(C(C1=O)C(=O)OC)(C)C
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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 C24H33NO6 MW 431.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33NO6/c1-7-8-17(26)20-16(14-24(2,3)21(22(20)27)23(28)31-6)25-12-11-15-9-10-18(29-4)19(13-15)30-5/h9-10,13,21,25H,7-8,11-12,14H2,1-6H3InChIKey
KSGCMLZHFUWZOE-UHFFFAOYSA-NSynonyms
InChI=1SC24H33NO6c17817(26)2016(1424(23)21(22(20)27)23(28)316)2512111591018(294)19(1315)305h910132125H78111214H216H3
methyl3butanoyl4((2(34dimethoxyphenyl)ethyl)amino)66dimethyl2oxocyclohex3ene1carboxylate
methyl3butyryl4((34dimethoxyphenethyl)amino)66dimethyl2oxocyclohex3enecarboxylate
MFCD00512890
ZINC000100551793
ZINC000100551794
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