PER-O-ACETYL-ALPHA-THIOPHENYL-N-ACETYLNEURAMINIC METHYL ESTER

pro_cas
118977-26-7 ;667463-36-7
pro_cdbregno
CCD00263618
pro_formula
C26 H33 N O12 S
pro_molWeight
583.608

basic_info

Product_Name: PER-O-ACETYL-ALPHA-THIOPHENYL-N-ACETYLNEURAMINIC METHYL ESTER
CAS: 118977-26-7 ;667463-36-7
EnglishSynonyms: METHYL 5-ACETAMIDO-4,7,8,9-TETRA-O-ACETYL-3,5-DIDEOXY-2-THIOPHENYL-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSYLONATE ; PER-O-ACETYL-ALPHA-THIOPHENYL-N-ACETYLNEURAMINIC METHYL ESTER
pro_mdlNumber: MFCD01862643
pro_acceptors: 13
pro_donors: 1
pro_smile: CC(=O)N[C@@H]1[C@H](C[C@@](O[C@H]1[C@@H]([C@@H](COC(=O)C)OC(=O)C)OC(=O)C)(C(=O)OC)Sc2ccccc2)OC(=O)C
InChi: InChI=1S/C26H33NO12S/c1-14(28)27-22-20(36-16(3)30)12-26(25(33)34-6,40-19-10-8-7-9-11-19)39-24(22)23(38-18(5)32)21(37-17(4)31)13-35-15(2)29/h7-11,20-24H,12-13H2,1-6H3,(H,27,28)/t20-,21+,22+,23+,24+,26-/m0/s1
InChiKey: InChIKey=NPLKOUSSDBQHEN-UQJVNAJPSA-N

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