Vitas-M small molecule compound
ethyl (4Z)-1-(2-methoxyethyl)-4-[3-methoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK165137
SMILES COCCN1C(=O)/C(=C\c2ccc(c(c2)OC)OCC=C)/C(=C1C)C(=O)OCC
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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 C22H27NO6 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO6/c1-6-11-29-18-9-8-16(14-19(18)27-5)13-17-20(22(25)28-7-2)15(3)23(21(17)24)10-12-26-4/h6,8-9,13-14H,1,7,10-12H2,2-5H3/b17-13-InChIKey
MGGYZTZHJOPMPT-LGMDPLHJSA-NSynonyms
CCOC(=O)C1=C(N(C(=O)C1=CC2=CC(=C(C=C2)OCC=C)OC)CCOC)C
COCCN1C(=O)C(=Cc2ccc(c(c2)OC)OCC=C)C(=C1C)C(=O)OCC
ETHYL(4Z)1(2METHOXYETHYL)4((3METHOXY4PROP2ENOXYPHENYL)METHYLIDENE)2METHYL5OXOPYRROLE3CARBOXYLATE
ETHYL(4Z)1(2METHOXYETHYL)4(3METHOXY4(PROP2EN1YLOXY)BENZYLIDENE)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC22H27NO6c161129189816(1419(18)275)131720(22(25)2872)15(3)23(21(17)24)1012264h6891314H171012H225H3b1713
MFCD03713381
ZINC000014010046
ZINC14010046
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