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(Q76616160)
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English
(E)-7-(4-hydroxyphenyl)-1-phenylhept-4-en-3-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
biogenic alkylphenol
0 references
mass
280.14632988
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₀O₂
0 references
canonical SMILES
O=C(C=CCCC1=CC=C(O)C=C1)CCC=2C=CC=CC2
0 references
isomeric SMILES
C1=CC=C(C=C1)CCC(=O)/C=C/CCC2=CC=C(C=C2)O
0 references
found in taxon
Alpinia officinarum
4 references
stated in
A new dimeric diarylheptanoid from the rhizomes of Alpinia officinarum
stated in
New diarylheptanoids from the rhizome of Alpinia officinarum Hance
stated in
In vitro and in vivo anti-influenza virus activity of diarylheptanoids isolated from Alpinia officinarum
stated in
New cytotoxic diarylheptanoids from the rhizomes of Alpinia officinarum
Identifiers
InChI
InChI=1S/C19H20O2/c20-18(13-10-16-6-2-1-3-7-16)9-5-4-8-17-11-14-19(21)15-12-17/h1-3,5-7,9,11-12,14-15,21H,4,8,10,13H2/b9-5+
0 references
InChIKey
VPCHZECKYCDVSA-WEVVVXLNSA-N
0 references
CAS Registry Number
100667-52-5
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
45783180
1 reference
matched by identifier from
InChIKey
InChIKey
VPCHZECKYCDVSA-WEVVVXLNSA-N
ChEBI ID
173996
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C19H20O2/c20-18(13-10-16-6-2-1-3-7-16)9-5-4-8-17-11-14-19(21)15-12-17/h1-3,5-7,9,11-12,14-15,21H,4,8,10,13H2/b9-5+
UniChem compound ID
6600403
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID101235744
1 reference
matched by identifier from
InChIKey
InChIKey
VPCHZECKYCDVSA-WEVVVXLNSA-N
Human Metabolome Database ID
HMDB0033295
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VPCHZECKYCDVSA-WEVVVXLNSA-N
KNApSAcK ID
C00056319
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VPCHZECKYCDVSA-WEVVVXLNSA-N
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