β-D-Glucopyranose, 1,2,6-tris(3-nitropropanoate)

CAS Registry Number®

1400-11-9

CAS Name

β-D-Glucopyranose, 1,2,6-tris(3-nitropropanoate)

Molecular Formula

C15H21N3O15

Molecular Mass

483.34

Cite this Page

β-D-Glucopyranose, 1,2,6-tris(3-nitropropanoate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1400-11-9 (retrieved 2024-11-22) (CAS RN: 1400-11-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H21N3O15/c19-9(1-4-16(24)25)30-7-8-12(22)13(23)14(32-10(20)2-5-17(26)27)15(31-8)33-11(21)3-6-18(28)29/h8,12-15,22-23H,1-7H2/t8-,12-,13+,14-,15+/m1/s1

InChIKey

InChIKey=CNURKUNYCXCBEK-WMNSZERYSA-N

SMILES

O(C(CCN(=O)=O)=O)[C@H]1[C@H](OC(CCN(=O)=O)=O)[C@@H](O)[C@H](O)[C@@H](COC(CCN(=O)=O)=O)O1

Canonical SMILES

O=C(OCC1OC(OC(=O)CCN(=O)=O)C(OC(=O)CCN(=O)=O)C(O)C1O)CCN(=O)=O

Other Names for this Substance

  • β-D-Glucopyranose, 1,2,6-tris(3-nitropropanoate)
  • Karakin
  • Carakin
  • NSC 279515

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