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(Q104195479)
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English
8-[[1-Hydroxy-3-(4-hydroxyphenyl)propan-2-yl]amino]-3,5-dimethyl-8-oxoocta-4,6-dienoic acid
group of stereoisomers with the chemical formula C₁₉H₂₅NO₅
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Statements
instance of
group of stereoisomers
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subclass of
chemical compound
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mass
347.1732728999999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₅NO₅
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canonical SMILES
CC(C=CC(=O)NC(CO)Cc1ccc(O)cc1)=CC(C)CC(=O)O
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Identifiers
InChI
InChI=1S/C19H25NO5/c1-13(9-14(2)10-19(24)25)3-8-18(23)20-16(12-21)11-15-4-6-17(22)7-5-15/h3-9,14,16,21-22H,10-12H2,1-2H3,(H,20,23)(H,24,25)
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InChIKey
PWIPPVISROQJBU-UHFFFAOYSA-N
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PubChem CID
72806676
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PWIPPVISROQJBU-UHFFFAOYSA-N
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