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(Q76084479)
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Dioclein
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5,2',5'-Trihydroxy-6,7-dimethoxyflavanon
1 reference
based on heuristic
inferred from SMILES
mass
332.089602852
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(2R)-2',5,5'-Trihydroxy-6,7-dimethoxyflavanone
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₁₆O₇
0 references
canonical SMILES
O=C1C2=C(O)C(OC)=C(OC)C=C2OC(C3=CC(O)=CC=C3O)C1
0 references
isomeric SMILES
COC1=C(C(=C2C(=O)C[C@H](OC2=C1)C3=C(C=CC(=C3)O)O)O)OC
0 references
found in taxon
Dioclea grandiflora
3 references
stated in
Dioclein, a flavanone from the roots of Dioclea grandiflora
stated in
Dioclein, a flavanone from the roots of Dioclea grandiflora
stated in
Analgesic effect of Dioclea grandiflora constituents in rodents
Macropsychanthus grandiflorus
2 references
stated in
Dioclein, a flavanone from the roots of Dioclea grandiflora
stated in
Analgesic effect of Dioclea grandiflora constituents in rodents
Identifiers
InChI
InChI=1S/C17H16O7/c1-22-14-7-13-15(16(21)17(14)23-2)11(20)6-12(24-13)9-5-8(18)3-4-10(9)19/h3-5,7,12,18-19,21H,6H2,1-2H3/t12-/m0/s1
0 references
InChIKey
LJTSNTOXRSAZNS-LBPRGKRZSA-N
0 references
CAS Registry Number
161748-44-3
0 references
PubChem CID
178055
1 reference
matched by identifier from
InChIKey
InChIKey
LJTSNTOXRSAZNS-LBPRGKRZSA-N
UniChem compound ID
28035315
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00936592
1 reference
matched by identifier from
InChIKey
InChIKey
LJTSNTOXRSAZNS-LBPRGKRZSA-N
DSSTOX compound identifier
DTXCID301365197
0 references
LIPID MAPS ID
LMPK12140604
1 reference
stated in
LIPID MAPS
reference URL
http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download
retrieved
30 June 2018
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