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(Q82042138)
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English
4-(4-hydroxy-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)butan-2-one
chemical compound
4-(4-Hydroxy-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)butan-2-one
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
279.147058152
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₁NO₄
0 references
canonical SMILES
CC(=O)CCN1CC(C2=CC(=C(C=C2C1)OC)OC)O
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Identifiers
InChI
InChI=1S/C15H21NO4/c1-10(17)4-5-16-8-11-6-14(19-2)15(20-3)7-12(11)13(18)9-16/h6-7,13,18H,4-5,8-9H2,1-3H3
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InChIKey
OXOIRASLXWAYFP-UHFFFAOYSA-N
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CAS Registry Number
16675-66-4
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167398-28-9
reason for deprecated rank
applies to other chemical entity
0 references
PubChem CID
280248
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
22906070
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70299641
0 references
DTXSID80937320
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DSSTOX compound identifier
DTXCID70250777
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DTXCID80953868
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NSC number
131704
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