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Lepidine B
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
imidazole alkaloid
0 references
mass
346.142975816
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₁₈N₄O₂
0 references
canonical SMILES
OC1=CC=CC(=C1OC2=CC=CC(=C2)CC3=NC=CN3)CC4=NC=CN4
0 references
found in taxon
garden cress
3 references
stated in
Seven imidazole alkaloids from Lepidium sativum
stated in
Seven imidazole alkaloids from Lepidium sativum
stated in
Seven imidazole alkaloids from Lepidium sativum
Identifiers
InChI
InChI=1S/C20H18N4O2/c25-17-6-2-4-15(13-19-23-9-10-24-19)20(17)26-16-5-1-3-14(11-16)12-18-21-7-8-22-18/h1-11,25H,12-13H2,(H,21,22)(H,23,24)
0 references
InChIKey
RQNSAUQJLRAUMV-UHFFFAOYSA-N
0 references
PubChem CID
100927764
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RQNSAUQJLRAUMV-UHFFFAOYSA-N
ChEBI ID
175380
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C20H18N4O2/c25-17-6-2-4-15(13-19-23-9-10-24-19)20(17)26-16-5-1-3-14(11-16)12-18-21-7-8-22-18/h1-11,25H,12-13H2,(H,21,22)(H,23,24)
UniChem compound ID
31994896
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0032715
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RQNSAUQJLRAUMV-UHFFFAOYSA-N
KNApSAcK ID
C00028459
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RQNSAUQJLRAUMV-UHFFFAOYSA-N
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