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(Q105307951)
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English
5-[[(2E)-3,7-Dimethyl-2,6-octadienyl]oxy]-7-hydroxy-2H-1-benzopyran-2-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2,6-dimethyloctane monoterpenoid
0 references
biogenic coumarin
0 references
mass
314.151809184
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₂O₄
0 references
canonical SMILES
O=C1OC2=CC(O)=CC(OCC=C(C)CCC=C(C)C)=C2C=C1
0 references
isomeric SMILES
CC(C)=CCC/C(C)=C/COc1cc(O)cc2oc(=O)ccc12
1 reference
based on heuristic
inferred from InChI
found in taxon
Clausena excavata
3 references
stated in
Constituents of Clausena excavata. Isolation and Structural Elucidation of Seven New Carbazole Alkaloids and a New Coumarin.
stated in
Constituents of Clausena excavata. Isolation and Structural Elucidation of Seven New Carbazole Alkaloids and a New Coumarin.
stated in
Constituents from Clausena excavata
Murraya koenigii
2 references
stated in
Chemical constituents of Murraya siamensis: three coumarins and their anti-tumor promoting effect.
stated in
Chemical constituents of Murraya siamensis: three coumarins and their anti-tumor promoting effect.
Murraya siamensis
2 references
stated in
Chemical constituents of Murraya siamensis: three coumarins and their anti-tumor promoting effect.
stated in
Chemical constituents of Murraya siamensis: three coumarins and their anti-tumor promoting effect.
Identifiers
InChI
InChI=1S/C19H22O4/c1-13(2)5-4-6-14(3)9-10-22-17-11-15(20)12-18-16(17)7-8-19(21)23-18/h5,7-9,11-12,20H,4,6,10H2,1-3H3/b14-9+
0 references
InChIKey
WLGKAJXVMRUMDU-NTEUORMPSA-N
0 references
PubChem CID
10829074
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WLGKAJXVMRUMDU-NTEUORMPSA-N
UniChem compound ID
33954514
1 reference
stated in
UniChem
KNApSAcK ID
C00060548
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WLGKAJXVMRUMDU-NTEUORMPSA-N
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