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(Q104170720)
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English
3-[4-(buta-2,3-dien-1-yloxy)phenyl]-N-(2-hydroxy-6-isopropyl-3,4,7-trimethyl-5,8-dioxo-1,4,7-triazacyclotridec-1-en-9-yl)prop-2-enimidic acid
group of stereoisomers with the chemical formula C₂₉H₄₀N₄O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
cinnamoylamide alkaloid
1 reference
inferred from
cinnamoylamide alkaloid
biogenic cyclopeptide
1 reference
inferred from
biogenic cyclopeptide
mass
524.29987038
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₉H₄₀N₄O₅
0 references
canonical SMILES
C=C=CCOc1ccc(C=CC(=O)NC2CCCCNC(=O)C(C)N(C)C(=O)C(C(C)C)N(C)C2=O)cc1
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Identifiers
InChI
InChI=1S/C29H40N4O5/c1-7-8-19-38-23-15-12-22(13-16-23)14-17-25(34)31-24-11-9-10-18-30-27(35)21(4)32(5)29(37)26(20(2)3)33(6)28(24)36/h8,12-17,20-21,24,26H,1,9-11,18-19H2,2-6H3,(H,30,35)(H,31,34)
0 references
InChIKey
KZGBTBDGCRRWLS-UHFFFAOYSA-N
0 references
PubChem CID
73197155
1 reference
matched by identifier from
InChIKey
InChIKey
KZGBTBDGCRRWLS-UHFFFAOYSA-N
163192356
1 reference
matched by identifier from
InChIKey
InChIKey
KZGBTBDGCRRWLS-UHFFFAOYSA-N
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