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(Q105215663)
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English
2-(hydroxymethyl)-6-[4-(1H-imidazol-2-ylmethyl)phenoxy]oxane-3,4,5-triol
group of stereoisomers with the chemical formula C₁₆H₂₀N₂O₆
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Statements
instance of
group of stereoisomers
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subclass of
imidazole alkaloid
1 reference
inferred from
imidazole alkaloid
mass
336.1321363599999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₂₀N₂O₆
0 references
canonical SMILES
OCC1OC(OC2=CC=C(C=C2)CC3=NC=CN3)C(O)C(O)C1O
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Identifiers
InChI
InChI=1S/C16H20N2O6/c19-8-11-13(20)14(21)15(22)16(24-11)23-10-3-1-9(2-4-10)7-12-17-5-6-18-12/h1-6,11,13-16,19-22H,7-8H2,(H,17,18)
0 references
InChIKey
PVXWBKJKWJZGQJ-UHFFFAOYSA-N
0 references
PubChem CID
131751375
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PVXWBKJKWJZGQJ-UHFFFAOYSA-N
UniChem compound ID
32022807
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0033107
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PVXWBKJKWJZGQJ-UHFFFAOYSA-N
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