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(Q105170920)
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English
(4E,6E,8E)-3-hydroxy-2,2,4-trimethyl-10-(1,3-oxazol-5-yl)deca-4,6,8-trienimidic acid
group of stereoisomers with the chemical formula C₁₆H₂₂N₂O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
oxazole alkaloid
1 reference
inferred from
oxazole alkaloid
mass
290.163042564
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₂N₂O₃
0 references
canonical SMILES
CC(=CC=CC=CCc1cnco1)C(O)C(C)(C)C(N)=O
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isomeric SMILES
C/C(=C\C=C\C=C\Cc1cnco1)C(O)C(C)(C)C(N)=O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C16H22N2O3/c1-12(14(19)16(2,3)15(17)20)8-6-4-5-7-9-13-10-18-11-21-13/h4-8,10-11,14,19H,9H2,1-3H3,(H2,17,20)/b6-4+,7-5+,12-8+
0 references
InChIKey
MRTUFVRJHFZVOT-FOTIZBECSA-N
0 references
PubChem CID
14831328
1 reference
matched by identifier from
InChIKey
InChIKey
MRTUFVRJHFZVOT-FOTIZBECSA-N
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