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(Q105178874)
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English
(2S,3R,4S,5R,6S)-2-(hydroxymethyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
salicin
1 reference
based on heuristic
inferred from SMILES
mass
286.105252916
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
(2S,3R,4R,5S,6R)-2-(hydroxymethyl)-6-[2-(hydroxymethyl)phenoxy]oxane-3,4,5-triol
1 reference
based on heuristic
inferred from InChI
D-(−)-salicin
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₈O₇
0 references
canonical SMILES
OCC=1C=CC=CC1OC2OC(CO)C(O)C(O)C2O
0 references
isomeric SMILES
OCc1ccccc1O[C@@H]1O[C@@H](CO)[C@H](O)[C@H](O)[C@H]1O
0 references
Identifiers
InChI
InChI=1S/C13H18O7/c14-5-7-3-1-2-4-8(7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11-,12+,13+/m0/s1
0 references
InChIKey
NGFMICBWJRZIBI-JZRPKSSGSA-N
0 references
PubChem CID
154497406
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
185784220
1 reference
stated in
UniChem
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