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(Q105112646)
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English
3-(4-Hydroxy-3-methoxyphenyl)-N-[3-[[4-[[3-(4-hydroxy-3-methoxyphenyl)-1-oxo-2-propen-1-yl]amino]butyl]amino]propyl]-2-propenamide
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
cinnamoylamide alkaloid
0 references
spermidine
0 references
mass
497.25258584
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₇H₃₅N₃O₆
0 references
canonical SMILES
COc1cc(C=CC(=O)NCCCCNCCCNC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O
0 references
found in taxon
Corylus avellana
1 reference
stated in
Hydroxycinnamic acid spermidine amides from pollen of corylus avellana L.
Identifiers
InChI
InChI=1S/C27H35N3O6/c1-35-24-18-20(6-10-22(24)31)8-12-26(33)29-16-4-3-14-28-15-5-17-30-27(34)13-9-21-7-11-23(32)25(19-21)36-2/h6-13,18-19,28,31-32H,3-5,14-17H2,1-2H3,(H,29,33)(H,30,34)
0 references
InChIKey
IGHVUFYLAJSILE-UHFFFAOYSA-N
0 references
CAS Registry Number
70185-61-4
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
163080747
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IGHVUFYLAJSILE-UHFFFAOYSA-N
DSSTox substance ID
DTXSID101102624
1 reference
matched by identifier from
InChIKey
InChIKey
IGHVUFYLAJSILE-UHFFFAOYSA-N
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