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(Q76303578)
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Neobavachalcone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3'C-substituted chalcone
0 references
mass
298.084123548
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₄O₅
0 references
canonical SMILES
O=CC1=CC(C(=O)C=CC2=CC=C(O)C=C2)=C(O)C=C1OC
0 references
isomeric SMILES
COC1=CC(=C(C=C1C=O)C(=O)/C=C/C2=CC=C(C=C2)O)O
0 references
found in taxon
Cullen corylifolia
1 reference
stated in
The structure and synthesis of neobavachalcone, a new component of Psoralea corylifolia.
Cullen corylifolium
1 reference
stated in
The structure and synthesis of neobavachalcone, a new component of Psoralea corylifolia.
Identifiers
InChI
InChI=1S/C17H14O5/c1-22-17-9-16(21)14(8-12(17)10-18)15(20)7-4-11-2-5-13(19)6-3-11/h2-10,19,21H,1H3/b7-4+
0 references
InChIKey
CMPZYNFZRHFABH-QPJJXVBHSA-N
0 references
PubChem CID
5320052
0 references
UniChem compound ID
43378313
1 reference
stated in
UniChem
KNApSAcK ID
C00007039
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CMPZYNFZRHFABH-QPJJXVBHSA-N
LIPID MAPS ID
LMPK12120073
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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