D-ASPARAGINE 4-NITROBENZYL ESTER TOSYLATE

pro_cas
pro_cdbregno
CCD00415311
pro_formula
C11 H13 N3 O5 . C7 H8 O3 S
pro_molWeight
439.443

basic_info

Product_Name: D-ASPARAGINE 4-NITROBENZYL ESTER TOSYLATE
EnglishSynonyms: H-D-ASN-ONB TOS ; D-ASPARAGINE 4-NITROBENZYL ESTER TOSYLATE
pro_mdlNumber: MFCD03788626
pro_acceptors: 8
pro_donors: 2
pro_smile: Cc1ccc(cc1)S(=O)(=O)O.c1cc(ccc1COC(=O)[C@@H](CC(=O)N)N)[N+](=O)[O-]
InChi: InChI=1S/C11H13N3O5.C7H8O3S/c12-9(5-10(13)15)11(16)19-6-7-1-3-8(4-2-7)14(17)18;1-6-2-4-7(5-3-6)11(8,9)10/h1-4,9H,5-6,12H2,(H2,13,15);2-5H,1H3,(H,8,9,10)/t9-;/m1./s1
InChiKey: InChIKey=KWQGHHADOKDUNS-SBSPUUFOSA-N

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