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(Q110184309)
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English
CID 56833075
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic alkylphenol
1 reference
based on heuristic
inferred from SMILES
mass
272.177630008
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₄O₂
0 references
canonical SMILES
OC1=CC=C(C=CC(C=C)(C)CCC=C(C)C)C=C1O
0 references
isomeric SMILES
C=C[C@@](C)(/C=C/c1ccc(O)c(O)c1)CCC=C(C)C
0 references
found in taxon
Cullen corylifolium
1 reference
stated in
Characterization of Compounds in Psoralea corylifolia Using High-Performance Liquid Chromatography Diode Array Detection, Time-of-Flight Mass Spectrometry and Quadrupole Ion Trap Mass Spectrometry
Cullen corylifolia
1 reference
stated in
Characterization of Compounds in Psoralea corylifolia Using High-Performance Liquid Chromatography Diode Array Detection, Time-of-Flight Mass Spectrometry and Quadrupole Ion Trap Mass Spectrometry
Identifiers
InChI
InChI=1S/C18H24O2/c1-5-18(4,11-6-7-14(2)3)12-10-15-8-9-16(19)17(20)13-15/h5,7-10,12-13,19-20H,1,6,11H2,2-4H3/b12-10+/t18-/m1/s1
0 references
InChIKey
ZHKCOGVKHHAUBK-NCUBBLFSSA-N
0 references
PubChem CID
56833075
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
32809745
1 reference
stated in
UniChem
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