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7-Methylthio-5.beta.,D-glucopyranosylaminopyrrolo[3,4-c]pyridin-1(3H)-dione
SpectraBase Compound ID 6CxEOoNIYP4
InChI InChI=1S/C14H17N3O7S/c1-25-14-7-4(11(22)17-12(7)23)2-6(16-14)15-13-10(21)9(20)8(19)5(3-18)24-13/h2,5,8-10,13,18-21H,3H2,1H3,(H,15,16)(H,17,22,23)/t5-,8-,9+,10-,13?/m1/s1
InChIKey NSWWEPDMQKWXCV-VASJAPIOSA-N
Mol Weight 371.36 g/mol
Molecular Formula C14H17N3O7S
Exact Mass 371.078721 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 17nTp9l1k1e
Name 7-Methylthio-5.beta.,D-glucopyranosylaminopyrrolo[3,4-c]pyridin-1(3H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17N3O7S
InChI InChI=1S/C14H17N3O7S/c1-25-14-7-4(11(22)17-12(7)23)2-6(16-14)15-13-10(21)9(20)8(19)5(3-18)24-13/h2,5,8-10,13,18-21H,3H2,1H3,(H,15,16)(H,17,22,23)/t5-,8-,9+,10-,13?/m1/s1
InChIKey NSWWEPDMQKWXCV-VASJAPIOSA-N
Molecular Weight 371.364 g/mol
SMILES N1C(c2c(c(nc(c2)NC2[C@@]([C@]([C@@]([C@@](CO)(O2)[H])(O)[H])(O)[H])(O)[H])SC)C1=O)=O
SPLASH splash10-00di-3090000000-8f1150cedddc2a8621b4
Source of Spectrum F-53-8233-2
Synonyms N-[4-(methylsulfanyl)-1,3-dioxo-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-6-yl]-D-glucopyranosylamine
Wiley ID 802436