Dhurrin
CAS Registry Number®
499-20-7
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CAS Name
DhurrinMolecular Formula
C14H17NO7Molecular Mass
311.29Cite this Page
Dhurrin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?ref=499-20-7 (retrieved ) (CAS RN: 499-20-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
200 °C (decomp)
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C14H17NO7/c15-5-9(7-1-3-8(17)4-2-7)21-14-13(20)12(19)11(18)10(6-16)22-14/h1-4,9-14,16-20H,6H2/t9-,10-,11-,12+,13-,14-/m1/s1
InChIKey
InChIKey=NVLTYOJHPBMILU-YOVYLDAJSA-N
SMILES
O([C@H](C#N)C1=CC=C(O)C=C1)[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O
Canonical SMILES
N#CC(OC1OC(CO)C(O)C(O)C1O)C2=CC=C(O)C=C2
Other Names for this Substance
- Benzeneacetonitrile, α-(β-D-glucopyranosyloxy)-4-hydroxy-, (αS)-
- Dhurrin
- Benzeneacetonitrile, α-(β-D-glucopyranosyloxy)-4-hydroxy-, (S)-
- Glucoside, α-cyano-p-hydroxybenzyl
- (αS)-α-(β-D-Glucopyranosyloxy)-4-hydroxybenzeneacetonitrile
Deleted or Replaced CAS Registry Numbers
96788-82-8, 802274-24-4
