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Methyl [methyl 5-acetamido-7-O-acetyl-3,4,5-trideoxy-4-C-methyl-8,9-O-(methylethylidene)-.beta.-D-glycero-D-talo-nonulopyranosid]onate
SpectraBase Compound ID 6Aq4z87scSA
InChI InChI=1S/C19H31NO9/c1-10-8-19(25-7,17(23)24-6)29-16(14(10)20-11(2)21)15(27-12(3)22)13-9-26-18(4,5)28-13/h10,13-16H,8-9H2,1-7H3,(H,20,21)/t10-,13?,14+,15+,16+,19+/m0/s1
InChIKey AVNRLRNVTIDTQT-CUXISDKKSA-N
Mol Weight 417.46 g/mol
Molecular Formula C19H31NO9
Exact Mass 417.199882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rOHyK82axx
Name Methyl [methyl 5-acetamido-7-O-acetyl-3,4,5-trideoxy-4-C-methyl-8,9-O-(methylethylidene)-.beta.-D-glycero-D-talo-nonulopyranosid]onate
Alternate Name(s) Methyl (2R,4R,5R)-6-[(S)-(acetyloxy)(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-5-acetamido-2-methoxy-4-methyloxane-2-carboxylate
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Formula C19H31NO9
InChI InChI=1S/C19H31NO9/c1-10-8-19(25-7,17(23)24-6)29-16(14(10)20-11(2)21)15(27-12(3)22)13-9-26-18(4,5)28-13/h10,13-16H,8-9H2,1-7H3,(H,20,21)/t10-,13?,14+,15+,16+,19+/m0/s1
InChIKey AVNRLRNVTIDTQT-CUXISDKKSA-N
Molecular Weight 417.455 g/mol
SMILES N([C@]1([C@@](O[C@@](C(=O)OC)(C[C@@]1(C)[H])OC)([C@@](C1OC(C)(C)OC1)(OC(=O)C)[H])[H])[H])C(=O)C
SPLASH splash10-014i-0000900000-07ce305cafde86ae74b0
Source of Spectrum AH-122-121-9
Wiley ID 1376788