升麻苷 ,80681-45-4 _ChemCD

升麻苷

basic_info
Product_Name：	升麻苷
CAS：	80681-45-4
中文同义词：	升麻素苷 ; 升麻苷
EnglishSynonyms：	PRIM-O-GLUCOSYLCIMIFUGIN ; CIMIFUGIN BETA-D-GLUCOPYRANOSIDE ; (2S)-2-(1-HYDROXY-1-METHYL-ETHYL)-4-METHOXY-7-[[(2R,3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)TETRAHYDROPYRAN-2-YL]OXYMETHYL]-2
pro_mdlNumber：	MFCD09037394
pro_acceptors：	11
pro_donors：	5
pro_smile：	CC(C)([C@@H]1Cc2c(cc3c(c2OC)c(=O)cc(o3)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O1)O
InChi：	InChI=1S/C22H28O11/c1-22(2,28)15-5-10-12(32-15)6-13-16(20(10)29-3)11(24)4-9(31-13)8-30-21-19(27)18(26)17(25)14(7-23)33-21/h4,6,14-15,17-19,21,23,25-28H,5,7-8H2,1-3H3/t14-,15+,17-,18+,19-,21-/m1/s1
InChiKey：	InChIKey=XIUVHOSBSDYXRG-UVTAEQIVSA-N

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