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English
Atractylodinol
chemical compound
(2E,8E)-9-(2-Furanyl)-2,8-nonadiene-4,6-diyn-1-ol
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
198.06807956
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₀O₂
0 references
canonical SMILES
OCC=CC#CC#CC=CC=1OC=CC1
0 references
isomeric SMILES
C1=COC(=C1)/C=C/C#CC#C/C=C/CO
0 references
found in taxon
Atractylodes lancea
3 references
stated in
Arginine Vasopressin and Angiotensin II Receptor Binding Inhibition by Atractylodes Species
stated in
Enzyme inhibitory activities of acetylene and sesquiterpene compounds in atractylodes rhizome
stated in
Further phenols and polyacetylenes from the rhizomes of Atractylodes lancea and their anti-inflammatory activity
Identifiers
InChI
InChI=1S/C13H10O2/c14-11-7-5-3-1-2-4-6-9-13-10-8-12-15-13/h5-10,12,14H,11H2/b7-5+,9-6+
0 references
InChIKey
JPWHLNBWBPJJJN-PDTNFJSOSA-N
0 references
CAS Registry Number
61642-89-5
0 references
PubChem CID
10012964
1 reference
matched by identifier from
InChIKey
InChIKey
JPWHLNBWBPJJJN-PDTNFJSOSA-N
UniChem compound ID
33557676
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50434134
1 reference
matched by identifier from
InChIKey
InChIKey
JPWHLNBWBPJJJN-PDTNFJSOSA-N
DSSTOX compound identifier
DTXCID30384961
0 references
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