蜀黍苷

pro_cas
499-20-7
pro_cdbregno
CCD04333475
pro_formula
C14 H17 N O7
pro_molWeight
311.288

basic_info

Product_Name: 蜀黍苷
CAS: 499-20-7
中文同义词: 蜀黍苷
EnglishSynonyms: (S)-(BETA-D-GLUCOPYRANOSYLOXY)(4-HYDROXYPHENYL)ACETONITRILE ; (S)-4-HYDROXYMANDELONITRILE BETA-D-GLUCOSIDE ; DHURRIN
pro_mdlNumber: MFCD18632527
pro_acceptors: 8
pro_donors: 5
pro_smile: c1cc(ccc1[C@@H](C#N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O
InChi: InChI=1S/C14H17NO7/c15-5-9(7-1-3-8(17)4-2-7)21-14-13(20)12(19)11(18)10(6-16)22-14/h1-4,9-14,16-20H,6H2/t9-,10-,11-,12+,13-,14-/m1/s1
InChiKey: InChIKey=NVLTYOJHPBMILU-YOVYLDAJSA-N

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