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methyl [methyl 5-acetamido-3,4,5-trideoxy-4-C-methyl-8,9-O-(methylethylidene)-.beta.-D-glycero-D-talo-nonulopyranosid]onate
SpectraBase Compound ID EX0ncvQSWMD
InChI InChI=1S/C17H29NO8/c1-9-7-17(23-6,15(21)22-5)26-14(12(9)18-10(2)19)13(20)11-8-24-16(3,4)25-11/h9,11-14,20H,7-8H2,1-6H3,(H,18,19)/t9-,11?,12+,13+,14+,17+/m0/s1
InChIKey DJVDEHYZCOJRCX-KYYSMWJSSA-N
Mol Weight 375.42 g/mol
Molecular Formula C17H29NO8
Exact Mass 375.189317 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID INfiHCcUDHr
Name methyl [methyl 5-acetamido-3,4,5-trideoxy-4-C-methyl-8,9-O-(methylethylidene)-.beta.-D-glycero-D-talo-nonulopyranosid]onate
Comments Less than 3 mono-isotopic peaks
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Formula C17H29NO8
InChI InChI=1S/C17H29NO8/c1-9-7-17(23-6,15(21)22-5)26-14(12(9)18-10(2)19)13(20)11-8-24-16(3,4)25-11/h9,11-14,20H,7-8H2,1-6H3,(H,18,19)/t9-,11?,12+,13+,14+,17+/m0/s1
InChIKey DJVDEHYZCOJRCX-KYYSMWJSSA-N
Molecular Weight 375.418 g/mol
SMILES N([C@@]1([C@](C[C@@](O[C@]1([C@@](C1OC(C)(C)OC1)(O)[H])[H])(C(=O)OC)OC)(C)[H])[H])C(=O)C
SPLASH splash10-004i-0009000000-d7457ea1b65051c5cb6b
Source of Spectrum AH-122-121-9
Synonyms methyl (2R,4R,5R)-6-[(S)-(2,2-dimethyl-1,3-dioxolan-4-yl)(hydroxy)methyl]-5-acetamido-2-methoxy-4-methyloxane-2-carboxylate
Wiley ID 1357111