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N-Acetylmethyl-N'-(3,4,6-tri-O-acetyl-2-deoxy-.alpha.-D-arabinohexopyranosyl)thiorea
SpectraBase Compound ID 8NBnHWL98P7
InChI InChI=1S/C16H24N2O8S/c1-8(19)6-17-16(27)18-14-5-12(24-10(3)21)15(25-11(4)22)13(26-14)7-23-9(2)20/h12-15H,5-7H2,1-4H3,(H2,17,18,27)/t12-,13-,14-,15+/m1/s1
InChIKey MVIGQEVNVASEHU-TUVASFSCSA-N
Mol Weight 404.43 g/mol
Molecular Formula C16H24N2O8S
Exact Mass 404.125337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 77g2RDXBH0W
Name N-Acetylmethyl-N'-(3,4,6-tri-O-acetyl-2-deoxy-.alpha.-D-arabinohexopyranosyl)thiorea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24N2O8S
InChI InChI=1S/C16H24N2O8S/c1-8(19)6-17-16(27)18-14-5-12(24-10(3)21)15(25-11(4)22)13(26-14)7-23-9(2)20/h12-15H,5-7H2,1-4H3,(H2,17,18,27)/t12-,13-,14-,15+/m1/s1
InChIKey MVIGQEVNVASEHU-TUVASFSCSA-N
Molecular Weight 404.434 g/mol
SMILES N([C@@]1(O[C@@]([C@]([C@@](C1)(OC(=O)C)[H])(OC(=O)C)[H])(COC(=O)C)[H])[H])C(=S)NCC(=O)C
SPLASH splash10-03di-9600000000-176b0a4d3f50d2724f99
Source of Spectrum F-47-5808-12
Synonyms 3,4,6-tri-O-acetyl-2-deoxy-N-{[(2-oxopropyl)amino]carbothioyl}-.beta.-D-arabino-hexopyranosylamine
Wiley ID 1371044