DICLOFENAC ACYL GLUCURONIDE

pro_cas
64118-81-6
pro_cdbregno
CCD00638201
pro_formula
C20 H19 Cl2 N O8
pro_molWeight
472.275

basic_info

Product_Name: DICLOFENAC ACYL GLUCURONIDE
CAS: 64118-81-6
EnglishSynonyms: DICLOFENAC ACYL-D-GLUCURONIDE ; DICLOFENAC ACYL-BETA-D-GLUCURONIDE ; DICLOFENAC ACYL GLUCURONIDE ; 1-O-[2-[(2',6'-DICHLOROPHENYL)AMINO)]PHENYLACETYL]-BETA-D-GLUCOPYRANURONIC ACID
pro_mdlNumber: MFCD08435953
pro_acceptors: 9
pro_donors: 5
pro_smile: c1ccc(c(c1)CC(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)Nc3c(cccc3Cl)Cl
InChi: InChI=1S/C20H19Cl2NO8/c21-10-5-3-6-11(22)14(10)23-12-7-2-1-4-9(12)8-13(24)30-20-17(27)15(25)16(26)18(31-20)19(28)29/h1-7,15-18,20,23,25-27H,8H2,(H,28,29)/t15-,16-,17+,18-,20+/m0/s1
InChiKey: InChIKey=JXIKYYSIYCILNG-HBWRTXEVSA-N

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