(3S,4R,4aS)-4-Ethenyl-3-(β-D-glucopyranosyloxy)-3,4,4a,5,6,7-hexahydro-8H-pyrano[3,4-c]pyridin-8-one

CAS Registry Number®

1398-17-0
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CAS Name

(3S,4R,4aS)-4-Ethenyl-3-(β-D-glucopyranosyloxy)-3,4,4a,5,6,7-hexahydro-8H-pyrano[3,4-c]pyridin-8-one

Molecular Formula

C16H23NO8

Molecular Mass

357.36

Cite this Page

(3S,4R,4aS)-4-Ethenyl-3-(β-D-glucopyranosyloxy)-3,4,4a,5,6,7-hexahydro-8H-pyrano[3,4-c]pyridin-8-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1398-17-0 (retrieved 2024-05-18) (CAS RN: 1398-17-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    200 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H23NO8/c1-2-7-8-3-4-17-14(22)9(8)6-23-15(7)25-16-13(21)12(20)11(19)10(5-18)24-16/h2,6-8,10-13,15-16,18-21H,1,3-5H2,(H,17,22)/t7-,8+,10-,11-,12+,13-,15+,16+/m1/s1

InChIKey

InChIKey=CYRRHDGXDUVPMO-ZASXJUAOSA-N

SMILES

C(=C)[C@@H]1[C@]2(C(=CO[C@H]1O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)NCC2)[H]

Canonical SMILES

O=C1NCCC2C1=COC(OC3OC(CO)C(O)C(O)C3O)C2C=C

Other Names for this Substance

  • 8H-Pyrano[3,4-c]pyridin-8-one, 4-ethenyl-3-(β-D-glucopyranosyloxy)-3,4,4a,5,6,7-hexahydro-, (3S,4R,4aS)-
  • 8H-Pyrano[3,4-c]pyridin-8-one, 4-ethenyl-3-(β-D-glucopyranosyloxy)-3,4,4a,5,6,7-hexahydro-, [3S-(3α,4β,4aα)]-
  • (3S,4R,4aS)-4-Ethenyl-3-(β-D-glucopyranosyloxy)-3,4,4a,5,6,7-hexahydro-8H-pyrano[3,4-c]pyridin-8-one
  • Bakankosin
  • Bakankosine

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