2-Cyclopentene-1-carbonitrile, 1-(β-D-glucopyranosyloxy)-4-(sulfooxy)-, (1S,4R)-

CAS Registry Number®

85758-30-1

CAS Name

2-Cyclopentene-1-carbonitrile, 1-(β-D-glucopyranosyloxy)-4-(sulfooxy)-, (1S,4R)-

Molecular Formula

C12H17NO10S

Molecular Mass

367.33

Cite this Page

2-Cyclopentene-1-carbonitrile, 1-(β-D-glucopyranosyloxy)-4-(sulfooxy)-, (1S,4R)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=85758-30-1 (retrieved 2024-11-08) (CAS RN: 85758-30-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H17NO10S/c13-5-12(2-1-6(3-12)23-24(18,19)20)22-11-10(17)9(16)8(15)7(4-14)21-11/h1-2,6-11,14-17H,3-4H2,(H,18,19,20)/t6-,7-,8-,9+,10-,11+,12-/m1/s1

InChIKey

InChIKey=OXUIYNFEUWRHJJ-QCMKSTAZSA-N

SMILES

O([C@@]1(C#N)C[C@H](OS(=O)(=O)O)C=C1)[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2

Canonical SMILES

N#CC1(OC2OC(CO)C(O)C(O)C2O)C=CC(OS(=O)(=O)O)C1

Other Names for this Substance

  • 2-Cyclopentene-1-carbonitrile, 1-(β-D-glucopyranosyloxy)-4-(sulfooxy)-, (1S,4R)-
  • 2-Cyclopentene-1-carbonitrile, 1-(β-D-glucopyranosyloxy)-4-(sulfooxy)-, (1S-trans)-

Deleted or Replaced CAS Registry Numbers

123497-98-3

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles