Vitas-M small molecule compound
ethyl (2Z)-{8-[(2Z)-2-(2-ethoxy-2-oxoethylidene)-5,5-dimethylpyrrolidin-3-ylidene]-3,3,6,10-tetramethyl-2-azaspiro[4.5]deca-6,9-dien-1-ylidene}ethanoate
Catalog ID
STK679255
SMILES CCOC(=O)/C=C/1\NC(C\C1=C\1/C=C(C)C2(C(=C1)C)CC(N/C/2=C\C(=O)OCC)(C)C)(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 C27H38N2O4 MW 454.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38N2O4/c1-9-32-23(30)13-21-20(15-25(5,6)28-21)19-11-17(3)27(18(4)12-19)16-26(7,8)29-22(27)14-24(31)33-10-2/h11-14,28-29H,9-10,15-16H2,1-8H3/b20-19-,21-13-,22-14-InChIKey
LXYBWBDLDKFNSB-HLYSYRHCSA-NSynonyms
CCOC(=O)C=C1NC(CC1=C1C=C(C)C2(C(=C1)C)CC(NC2=CC(=O)OCC)(C)C)(C)C
ethyl(2Z)(8((2Z)2(2ethoxy2oxoethylidene)55dimethylpyrrolidin3ylidene)33610tetramethyl2azaspiro(45)deca69dien1ylidene)ethanoate
MFCD03408948
ZINC000008857237
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