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(Q82873397)
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Licochalcone E
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-[4-hydroxy-2-methoxy-5-(3-methylbut-3-en-2-yl)phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one
1 reference
based on heuristic
inferred from SMILES
mass
338.151809184
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(E)-3-[4-hydroxy-2-methoxy-5-[(2R)-3-methylbut-3-en-2-yl]phenyl]-1-(4-hydroxyphenyl)prop-2-en-1-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₂O₄
0 references
canonical SMILES
O=C(C=CC1=CC(=C(O)C=C1OC)C(C(=C)C)C)C2=CC=C(O)C=C2
0 references
isomeric SMILES
C[C@H](C1=C(C=C(C(=C1)/C=C/C(=O)C2=CC=C(C=C2)O)OC)O)C(=C)C
0 references
found in taxon
Glycyrrhiza inflata
4 references
stated in
Cytotoxic allyl retrochalcone from the roots of Glycyrrhiza inflata
stated in
Cytotoxic allyl retrochalcone from the roots of Glycyrrhiza inflata
stated in
Inhibitory effect of chalcones and their derivatives from Glycyrrhiza inflata on protein tyrosine phosphatase 1B.
stated in
Screening for bioactive natural products from a 67-compound library of Glycyrrhiza inflata
Identifiers
InChI
InChI=1S/C21H22O4/c1-13(2)14(3)18-11-16(21(25-4)12-20(18)24)7-10-19(23)15-5-8-17(22)9-6-15/h5-12,14,22,24H,1H2,2-4H3/b10-7+/t14-/m0/s1
0 references
InChIKey
SWPKMTGYQGHLJS-RNVIBTMRSA-N
0 references
PubChem CID
46209991
1 reference
matched by identifier from
InChIKey
InChIKey
SWPKMTGYQGHLJS-RNVIBTMRSA-N
SureChEMBL ID
SCHEMBL26114169
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SWPKMTGYQGHLJS-RNVIBTMRSA-N
UniChem compound ID
1079035
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40904154
1 reference
matched by identifier from
InChIKey
InChIKey
SWPKMTGYQGHLJS-RNVIBTMRSA-N
DSSTOX compound identifier
DTXCID501332039
0 references
Probes And Drugs ID
PD125334
0 references
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