Glucolimnanthin

CAS Registry Number®

111810-95-8

CAS Name

Glucolimnanthin

Molecular Formula

C15H21NO10S2

Molecular Mass

439.46

Cite this Page

Glucolimnanthin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=111810-95-8 (retrieved 2024-09-28) (CAS RN: 111810-95-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H21NO10S2/c1-24-9-4-2-3-8(5-9)6-11(16-26-28(21,22)23)27-15-14(20)13(19)12(18)10(7-17)25-15/h2-5,10,12-15,17-20H,6-7H2,1H3,(H,21,22,23)/t10-,12-,13+,14-,15+/m1/s1

InChIKey

InChIKey=RYDIUEJGEAUJAI-LFHLZQBKSA-N

SMILES

S(C(CC1=CC(OC)=CC=C1)=NOS(=O)(=O)O)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O

Canonical SMILES

O=S(=O)(O)ON=C(SC1OC(CO)C(O)C(O)C1O)CC=2C=CC=C(OC)C2

Other Names for this Substance

  • β-D-Glucopyranose, 1-thio-, 1-[3-methoxy-N-(sulfooxy)benzeneethanimidate]
  • Glucolimnanthin
  • m-Methoxyglucotropaeolin
  • m-Methoxybenzylglucosinolate
  • 3-Methoxybenzyl-glucosinolate

CAS INSIGHTSTM
© Nobel Prize Outreach. Photo: Hugh Fox