(((2E)-2-ACETYL-3-[(5E)-5-(2-HYDROXY-3-METHOXYBENZYLIDENE)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL]-2-PROPENOYL)AMINO)ACETIC ACID

pro_cas
pro_cdbregno
CCD08153780
pro_formula
C18 H16 N2 O7 S2
pro_molWeight
436.463

basic_info

Product_Name: (((2E)-2-ACETYL-3-[(5E)-5-(2-HYDROXY-3-METHOXYBENZYLIDENE)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL]-2-PROPENOYL)AMINO)ACETIC ACID
EnglishSynonyms: (((2E)-2-ACETYL-3-[(5E)-5-(2-HYDROXY-3-METHOXYBENZYLIDENE)-4-OXO-2-THIOXO-1,3-THIAZOLIDIN-3-YL]-2-PROPENOYL)AMINO)ACETIC ACID
pro_mdlNumber: MFCD02672470
pro_acceptors: 9
pro_donors: 3
pro_smile: CC(=O)/C(=C\N1C(=O)/C(=C\c2cccc(c2O)OC)/SC1=S)/C(=O)NCC(=O)O
InChi: InChI=1S/C18H16N2O7S2/c1-9(21)11(16(25)19-7-14(22)23)8-20-17(26)13(29-18(20)28)6-10-4-3-5-12(27-2)15(10)24/h3-6,8,24H,7H2,1-2H3,(H,19,25)(H,22,23)/b11-8+,13-6+
InChiKey: InChIKey=OBGQGEXUEZREAX-ABHUBJDASA-N

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