β-D-Glucopyranose, 1-thio-, 1,2,3,4,6-pentaacetate

CAS Registry Number®

13639-50-4
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CAS Name

β-D-Glucopyranose, 1-thio-, 1,2,3,4,6-pentaacetate

Molecular Formula

C16H22O10S

Molecular Mass

406.40

Cite this Page

β-D-Glucopyranose, 1-thio-, 1,2,3,4,6-pentaacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=13639-50-4 (retrieved 2024-05-15) (CAS RN: 13639-50-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    121 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H22O10S/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(26-12)27-11(5)21/h12-16H,6H2,1-5H3/t12-,13-,14+,15-,16+/m1/s1

InChIKey

InChIKey=CFAJEDWNNGFOQV-LJIZCISZSA-N

SMILES

O(C(C)=O)[C@H]1[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@@H](SC(C)=O)[C@@H]1OC(C)=O

Canonical SMILES

O=C(OCC1OC(SC(=O)C)C(OC(=O)C)C(OC(=O)C)C1OC(=O)C)C

Other Names for this Substance

  • β-D-Glucopyranose, 1-thio-, 1,2,3,4,6-pentaacetate
  • Glucopyranose, 1-thio-, pentaacetate, β-D-
  • β-D-Glucopyranose, 1-thio-, pentaacetate
  • Acetic acid, thio-, S-ester with 1-thio-β-D-glucopyranose 2,3,4,6-tetraacetate
  • 2,3,4,6-Tetra-O-acetyl-1-S-acetyl-1-thio-β-D-glucopyranose

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Deleted or Replaced CAS Registry Numbers

130539-65-0, 1508272-50-1, 2228865-25-4

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