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(Q82709663)
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English
5-(Pentacos-1-en-1-yl)benzene-1,3-diol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic alkylphenol
0 references
mass
458.412380968
dalton
1 reference
stated in
PubChem
PubChem CID
71328263
chemical formula
C₃₁H₅₄O₂
0 references
canonical SMILES
OC=1C=C(O)C=C(C=CCCCCCCCCCCCCCCCCCCCCCCC)C1
0 references
found in taxon
Triticum aestivum
1 reference
stated in
Determination of alkylresorcinols in cereal-based foods
Identifiers
InChI
InChI=1S/C31H54O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-26-30(32)28-31(33)27-29/h24-28,32-33H,2-23H2,1H3
0 references
InChIKey
VURYBPDWGJKISB-UHFFFAOYSA-N
0 references
CAS Registry Number
91490-99-2
0 references
PubChem CID
71328263
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
VURYBPDWGJKISB-UHFFFAOYSA-N
UniChem compound ID
68196026
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90757233
1 reference
matched by identifier from
InChIKey
InChIKey
VURYBPDWGJKISB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID10707977
0 references
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