Vitas-M small molecule compound
N-[2-(3,4-diethoxyphenyl)-1-(4,4-dimethyl-2,6-dioxocyclohexylidene)ethyl]glycine
Catalog ID
STK682317
SMILES CCOc1cc(ccc1OCC)CC(=C1C(=O)CC(CC1=O)(C)C)NCC(=O)O
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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 C22H29NO6 MW 403.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29NO6/c1-5-28-18-8-7-14(10-19(18)29-6-2)9-15(23-13-20(26)27)21-16(24)11-22(3,4)12-17(21)25/h7-8,10,23H,5-6,9,11-13H2,1-4H3,(H,26,27)InChIKey
BBOKAUABENOYIC-UHFFFAOYSA-NSynonyms
2((2(34DIETHOXYPHENYL)1(44DIMETHYL26DIOXOCYCLOHEXYLIDENE)ETHYL)AMINO)ACETICACID
CCOC1=C(C=C(C=C1)CC(=C2C(=O)CC(CC2=O)(C)C)NCC(=O)O)OCC
InChI=1SC22H29NO6c1528188714(1019(18)2962)915(231320(26)27)2116(24)1122(34)1217(21)25h781023H5691113H214H3(H2627)
MFCD03855298
N(2(34diethoxyphenyl)1(44dimethyl26dioxocyclohexylidene)ethyl)glycine
ZINC000100147602
ZINC100147602
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