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(Q105308192)
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English
7-[(3,7-Dimethyl-7-methoxy-2,5-octadienyl)oxy]-8-methoxycoumarin
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
358.178023932
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₆O₅
0 references
canonical SMILES
O=C1OC=2C(OC)=C(OCC=C(C)CC=CC(OC)(C)C)C=CC2C=C1
0 references
isomeric SMILES
COc1c(OC/C=C(\C)C/C=C/C(C)(C)OC)ccc2ccc(=O)oc12
1 reference
based on heuristic
inferred from InChI
found in taxon
Zanthoxylum schinifolium
1 reference
stated in
Coumarins and antiplatelet constituents from the root bark of Zanthoxylum schinifolium
Identifiers
InChI
InChI=1S/C21H26O5/c1-15(7-6-13-21(2,3)24-5)12-14-25-17-10-8-16-9-11-18(22)26-19(16)20(17)23-4/h6,8-13H,7,14H2,1-5H3/b13-6+,15-12+
0 references
InChIKey
WLTATNKUESCCJM-LHXNCXNZSA-N
0 references
PubChem CID
101585152
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WLTATNKUESCCJM-LHXNCXNZSA-N
UniChem compound ID
96777210
1 reference
stated in
UniChem
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