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(Q105259991)
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English
[(1r,4r)-4-(prop-1-en-2-yl)cyclohexyl]methyl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkyl caffeate ester
0 references
menthane monoterpenoids
0 references
mass
316.167459248
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₄O₄
0 references
canonical SMILES
O=C(OCC1CCC(C(=C)C)CC1)C=CC2=CC=C(O)C(O)=C2
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isomeric SMILES
C=C(C)[C@H]1CC[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)CC1
1 reference
based on heuristic
inferred from InChI
found in taxon
Perilla frutescens
1 reference
stated in
Novel Antioxidants Isolated from Perilla frutescens Britton var. crispa (Thunb.).
Identifiers
InChI
InChI=1S/C19H24O4/c1-13(2)16-7-3-15(4-8-16)12-23-19(22)10-6-14-5-9-17(20)18(21)11-14/h5-6,9-11,15-16,20-21H,1,3-4,7-8,12H2,2H3/b10-6+/t15-,16-
0 references
InChIKey
SSVXLIRLGPMWSL-LHHGAGPPSA-N
0 references
CAS Registry Number
179694-78-1
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
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