Desulfoglucobrassicin

CAS Registry Number®

43110-92-5

CAS Name

Desulfoglucobrassicin

Molecular Formula

C16H20N2O6S

Molecular Mass

368.40

Cite this Page

Desulfoglucobrassicin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=43110-92-5 (retrieved 2024-11-05) (CAS RN: 43110-92-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H20N2O6S/c19-7-11-13(20)14(21)15(22)16(24-11)25-12(18-23)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-17,19-23H,5,7H2/t11-,13-,14+,15-,16+/m1/s1

InChIKey

InChIKey=CWNIQCOMWQROPA-JZYAIQKZSA-N

SMILES

C(C(S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=NO)C=2C=3C(NC2)=CC=CC3

Canonical SMILES

ON=C(SC1OC(CO)C(O)C(O)C1O)CC2=CNC=3C=CC=CC32

Other Names for this Substance

  • β-D-Glucopyranose, 1-thio-, 1-(N-hydroxy-1H-indole-3-ethanimidate)
  • Desulfoglucobrassicin
  • 3-Indolylmethyldesulfoglucosinolate
  • Desulfoglucobrassicanapin

Deleted or Replaced CAS Registry Numbers

1179346-40-7

CAS INSIGHTSTM
Abstract Background of Blurry Golden Particles