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(Q104667787)
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English
1-[3-(4-Methoxyphenyl)prop-2-enoyl]-8-phenyl-1,5,9,13-tetrazacycloheptadecan-6-one
group of stereoisomers with the chemical formula C₂₉H₄₀N₄O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
cinnamoylamide alkaloid
1 reference
inferred from
cinnamoylamide alkaloid
mass
492.31004114
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₄₀N₄O₃
0 references
canonical SMILES
COc1ccc(C=CC(=O)N2CCCCNCCCNC(c3ccccc3)CC(=O)NCCC2)cc1
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Identifiers
InChI
InChI=1S/C29H40N4O3/c1-36-26-14-11-24(12-15-26)13-16-29(35)33-21-6-5-17-30-18-7-19-31-27(25-9-3-2-4-10-25)23-28(34)32-20-8-22-33/h2-4,9-16,27,30-31H,5-8,17-23H2,1H3,(H,32,34)
0 references
InChIKey
XHTALCPRDZVQLY-UHFFFAOYSA-N
0 references
PubChem CID
162850664
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XHTALCPRDZVQLY-UHFFFAOYSA-N
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