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.beta.-D-Glucopyranose, 1-thio-, 2,3,4,6-tetraacetate 1-[3-(acetyloxy)-N-hydroxy-4-pentenimidate], (Z)-
SpectraBase Compound ID HgeCHvpCVvI
InChI InChI=1S/C21H29NO12S/c1-7-15(30-11(3)24)8-17(22-28)35-21-20(33-14(6)27)19(32-13(5)26)18(31-12(4)25)16(34-21)9-29-10(2)23/h7,15-16,18-21,28H,1,8-9H2,2-6H3/b22-17+/t15?,16-,18-,19+,20-,21+/m1/s1
InChIKey LHBGGNPNJIUMQG-FGDZGQLHSA-N
Mol Weight 519.52 g/mol
Molecular Formula C21H29NO12S
Exact Mass 519.141047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3v2cfHTI0ut
Name .beta.-D-Glucopyranose, 1-thio-, 2,3,4,6-tetraacetate 1-[3-(acetyloxy)-N-hydroxy-4-pentenimidate], (Z)-
CAS Registry Number 87861-17-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29NO12S
InChI InChI=1S/C21H29NO12S/c1-7-15(30-11(3)24)8-17(22-28)35-21-20(33-14(6)27)19(32-13(5)26)18(31-12(4)25)16(34-21)9-29-10(2)23/h7,15-16,18-21,28H,1,8-9H2,2-6H3/b22-17+/t15?,16-,18-,19+,20-,21+/m1/s1
InChIKey LHBGGNPNJIUMQG-FGDZGQLHSA-N
Molecular Weight 519.518 g/mol
SMILES O\N=C/(S[C@]1([C@@]([C@]([C@](OC(=O)C)([C@](O1)(COC(=O)C)[H])[H])(OC(=O)C)[H])(OC(=O)C)[H])[H])CC(OC(=O)C)C=C
SPLASH splash10-0006-9200000000-826767501fb426a00376
Source of Spectrum KC-1983-720-0
Synonyms (5E)-5-(hydroxyimino)-5-{[(2S,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-[(acetyloxy)methyl]oxan-2-yl]sulfanyl}pent-1-en-3-yl acetate S-(2,3,5,6-tetra-O-acetyl-.beta.-D-glucopyranosyl)-3-acetoxybut-4-enylthiohydroximate
Wiley ID 1401812