芸薹葡糖硫苷

pro_cas
4356-52-9
pro_cdbregno
CCD02755982
pro_formula
C16 H19 N2 O9 S2 . K
pro_molWeight
486.561

basic_info

Product_Name: 芸薹葡糖硫苷
CAS: 4356-52-9
中文同义词: 芸薹葡糖硫苷 ; N-{[5-(二甲氨基)萘-1-基]磺酰}甘氨酰-4-硝基-L-苯基丙氨酰-L-脯氨酸
EnglishSynonyms: GLUCOBRASSICIN (POTASSIUM SALT)
pro_mdlNumber: MFCD16294848
pro_acceptors: 11
pro_donors: 5
pro_smile: c1ccc2c(c1)c(c[nH]2)C/C(=N\OS(=O)(=O)[O-])/S[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O.[K+]
InChi: InChI=1S/C16H20N2O9S2.K/c19-7-11-13(20)14(21)15(22)16(26-11)28-12(18-27-29(23,24)25)5-8-6-17-10-4-2-1-3-9(8)10;/h1-4,6,11,13-17,19-22H,5,7H2,(H,23,24,25);/q;+1/p-1/b18-12+;/t11-,13-,14+,15-,16+;/m1./s1
InChiKey: InChIKey=NSURXWDIGUNLJB-YBOYLLCLSA-M

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