3-Nitropropyl β-D-glucopyranoside

CAS Registry Number®

24502-76-9

CAS Name

3-Nitropropyl β-D-glucopyranoside

Molecular Formula

C9H17NO8

Molecular Mass

267.23

Cite this Page

3-Nitropropyl β-D-glucopyranoside.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=24502-76-9 (retrieved 2024-11-22) (CAS RN: 24502-76-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H17NO8/c11-4-5-6(12)7(13)8(14)9(18-5)17-3-1-2-10(15)16/h5-9,11-14H,1-4H2/t5-,6-,7+,8-,9-/m1/s1

InChIKey

InChIKey=JDJSHLXEHWCLEP-SYHAXYEDSA-N

SMILES

O(CCCN(=O)=O)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O

Canonical SMILES

O=N(=O)CCCOC1OC(CO)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranoside, 3-nitropropyl
  • Glucopyranoside, 3-nitropropyl, β-D-
  • 3-Nitropropyl β-D-glucopyranoside
  • Miserotoxin
  • 3-Nitro-1-propanol β-glucoside

Deleted or Replaced CAS Registry Numbers

25182-83-6