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(Q105346915)
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English
2-(3-(2-((1H-Imidazol-2-yl)methyl)-6-methoxyphenoxy)benzyl)-1H-imidazole
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
imidazole alkaloid
0 references
mass
360.15862588
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₀N₄O₂
0 references
canonical SMILES
N=1C=CNC1CC=2C=CC=C(OC=3C(OC)=CC=CC3CC4=NC=CN4)C2
0 references
found in taxon
garden cress
1 reference
stated in
Seven imidazole alkaloids from Lepidium sativum
Identifiers
InChI
InChI=1S/C21H20N4O2/c1-26-18-7-3-5-16(14-20-24-10-11-25-20)21(18)27-17-6-2-4-15(12-17)13-19-22-8-9-23-19/h2-12H,13-14H2,1H3,(H,22,23)(H,24,25)
0 references
InChIKey
YDQJXVYGARVLRT-UHFFFAOYSA-N
0 references
CAS Registry Number
100108-65-4
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
131751423
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YDQJXVYGARVLRT-UHFFFAOYSA-N
UniChem compound ID
31995064
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID101138201
1 reference
matched by identifier from
InChIKey
InChIKey
YDQJXVYGARVLRT-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0033437
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YDQJXVYGARVLRT-UHFFFAOYSA-N
KNApSAcK ID
C00056304
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YDQJXVYGARVLRT-UHFFFAOYSA-N
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