NITROCYCLINE

pro_cas
5585-59-1
pro_cdbregno
CCD00174128
pro_formula
C21 H21 N3 O9
pro_molWeight
459.409

basic_info

Product_Name: NITROCYCLINE
CAS: 5585-59-1
EnglishSynonyms: NITROCYCLINE
pro_mdlNumber: MFCD00865090
pro_acceptors: 12
pro_donors: 5
pro_smile: CN(C)[C@H]1[C@@H]2C[C@@H]3Cc4c(ccc(c4C(=O)C3=C([C@@]2(C(=O)C(=C1O)C(=O)N)O)O)O)[N+](=O)[O-]
InChi: InChI=1S/C21H21N3O9/c1-23(2)15-9-6-7-5-8-10(24(32)33)3-4-11(25)13(8)16(26)12(7)18(28)21(9,31)19(29)14(17(15)27)20(22)30/h3-4,7,9,15,25,27-28,31H,5-6H2,1-2H3,(H2,22,30)/t7-,9-,15-,21-/m0/s1
InChiKey: InChIKey=PHMPSHIUYYLXKR-UVPAEMEASA-N

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