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(Q105111951)
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English
Salicin, 6'-acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[3,4,5-Trihydroxy-6-[2-(hydroxymethyl)phenoxy]oxan-2-yl]methyl acetate
1 reference
based on heuristic
inferred from SMILES
mass
328.1158176
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
salicin 6'-acetate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₈
0 references
canonical SMILES
O=C(OCC1OC(OC=2C=CC=CC2CO)C(O)C(O)C1O)C
0 references
isomeric SMILES
CC(=O)OC[C@@H]1O[C@H](Oc2ccccc2CO)[C@@H](O)[C@H](O)[C@H]1O
0 references
found in taxon
Salix pentandroides
1 reference
stated in
Phenolic glycosides of the roots of Salix pentandroides
Identifiers
InChI
InChI=1S/C15H20O8/c1-8(17)21-7-11-12(18)13(19)14(20)15(23-11)22-10-5-3-2-4-9(10)6-16/h2-5,11-16,18-20H,6-7H2,1H3/t11-,12-,13+,14-,15-/m0/s1
0 references
InChIKey
IERQJNGBILWLCY-RMEBNNNOSA-N
0 references
PubChem CID
3084324
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IERQJNGBILWLCY-RMEBNNNOSA-N
UniChem compound ID
67844742
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60941526
1 reference
matched by identifier from
InChIKey
InChIKey
IERQJNGBILWLCY-RMEBNNNOSA-N
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