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(5R,6R,7S,8S,8aS)-N-(6,7,8-Trihydroxy-5-hydroxymethyl-1-{[1'S,2'S,3'R,4'S,5'R]-3',4'-dihydroxy-5'-hydroxymethyl-1'-methoxytetrahydropyran-2'-ylacetamide-2"-yl})hexahydroimidazo[1,2-a]pyridine-2,3-dione
SpectraBase Compound ID 65IbSWwL0s2
InChI InChI=1S/C17H27N3O12/c1-31-17-8(11(26)10(25)6(4-22)32-17)18-7(23)2-19-14-13(28)12(27)9(24)5(3-21)20(14)16(30)15(19)29/h5-6,8-14,17,21-22,24-28H,2-4H2,1H3,(H,18,23)/t5-,6-,8+,9-,10-,11-,12+,13-,14+,17+/m1/s1
InChIKey WDHSFXFENCWREH-CKEUSDORSA-N
Mol Weight 465.41 g/mol
Molecular Formula C17H27N3O12
Exact Mass 465.159473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2BYVROBvJWH
Name (5R,6R,7S,8S,8aS)-N-(6,7,8-Trihydroxy-5-hydroxymethyl-1-{[1'S,2'S,3'R,4'S,5'R]-3',4'-dihydroxy-5'-hydroxymethyl-1'-methoxytetrahydropyran-2'-ylacetamide-2"-yl})hexahydroimidazo[1,2-a]pyridine-2,3-dione
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Formula C17H27N3O12
InChI InChI=1S/C17H27N3O12/c1-31-17-8(11(26)10(25)6(4-22)32-17)18-7(23)2-19-14-13(28)12(27)9(24)5(3-21)20(14)16(30)15(19)29/h5-6,8-14,17,21-22,24-28H,2-4H2,1H3,(H,18,23)/t5-,6-,8+,9-,10-,11-,12+,13-,14+,17+/m1/s1
InChIKey WDHSFXFENCWREH-CKEUSDORSA-N
Molecular Weight 465.412 g/mol
SMILES N([C@]1([C@]([C@@]([C@](O[C@@]1(OC)[H])(CO)[H])(O)[H])(O)[H])[H])C(CN1[C@]2(N([C@](CO)([C@]([C@@]([C@]2(O)[H])(O)[H])(O)[H])[H])C(C1=O)=O)[H])=O
SPLASH splash10-0a4i-9200000000-65f6a58fa7c992c7f3ad
Source of Spectrum F-70-9903-7
Wiley ID 1597927