(1R,3S,4S,6R)-6-(β-D-Glucopyranosyloxy)-3-(hydroxymethyl)-1,3-dimethylbicyclo[2.2.1]heptan-2-one

CAS Registry Number®

217960-73-1

CAS Name

(1R,3S,4S,6R)-6-(β-D-Glucopyranosyloxy)-3-(hydroxymethyl)-1,3-dimethylbicyclo[2.2.1]heptan-2-one

Molecular Formula

C16H26O8

Molecular Mass

346.37

Cite this Page

(1R,3S,4S,6R)-6-(β-D-Glucopyranosyloxy)-3-(hydroxymethyl)-1,3-dimethylbicyclo[2.2.1]heptan-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=217960-73-1 (retrieved 2024-11-22) (CAS RN: 217960-73-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H26O8/c1-15-4-7(16(2,6-18)14(15)22)3-9(15)24-13-12(21)11(20)10(19)8(5-17)23-13/h7-13,17-21H,3-6H2,1-2H3/t7-,8-,9-,10-,11+,12-,13+,15-,16-/m1/s1

InChIKey

InChIKey=QZAWDTYMSDWVFW-PSDFPDBRSA-N

SMILES

C[C@]12[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@](C1)([C@](CO)(C)C2=O)[H]

Canonical SMILES

O=C1C(C)(CO)C2CC(OC3OC(CO)C(O)C(O)C3O)C1(C)C2

Other Names for this Substance

  • Bicyclo[2.2.1]heptan-2-one, 6-(β-D-glucopyranosyloxy)-3-(hydroxymethyl)-1,3-dimethyl-, (1R,3S,4S,6R)-
  • (1R,3S,4S,6R)-6-(β-D-Glucopyranosyloxy)-3-(hydroxymethyl)-1,3-dimethylbicyclo[2.2.1]heptan-2-one