4-Isothiocyanatophenyl 2-(acetylamino)-2-deoxy-β-D-glucopyranoside
CAS Registry Number®
20581-43-5
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CAS Name
4-Isothiocyanatophenyl 2-(acetylamino)-2-deoxy-β-D-glucopyranosideMolecular Formula
C15H18N2O6SMolecular Mass
354.38Cite this Page
4-Isothiocyanatophenyl 2-(acetylamino)-2-deoxy-β-D-glucopyranoside. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=20581-43-5 (retrieved ) (CAS RN: 20581-43-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C15H18N2O6S/c1-8(19)17-12-14(21)13(20)11(6-18)23-15(12)22-10-4-2-9(3-5-10)16-7-24/h2-5,11-15,18,20-21H,6H2,1H3,(H,17,19)/t11-,12-,13-,14-,15-/m1/s1
InChIKey
InChIKey=HJZSQYSGYXWFQT-KJWHEZOQSA-N
SMILES
O([C@H]1[C@H](NC(C)=O)[C@@H](O)[C@H](O)[C@@H](CO)O1)C2=CC=C(N=C=S)C=C2
Canonical SMILES
O=C(NC1C(O)C(O)C(OC1OC2=CC=C(N=C=S)C=C2)CO)C
Other Names for this Substance
- β-D-Glucopyranoside, 4-isothiocyanatophenyl 2-(acetylamino)-2-deoxy-
- Isothiocyanic acid, p-[(2-acetamido-2-deoxy-β-D-glucopyranosyl)oxy]phenyl ester
- 4-Isothiocyanatophenyl 2-(acetylamino)-2-deoxy-β-D-glucopyranoside