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(Q82042133)
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(Redirected from
Q82945849
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English
4-(8-hydroxy-7,8-dihydro[1,3]dioxolo[4,5-g]isoquinolin-6(5h)-yl)butan-2-one
chemical compound
4-(8-Hydroxy-7,8-dihydro-2H-[1,3]dioxolo[4,5-g]isoquinolin-6(5H)-yl)butan-2-one
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
263.115758024
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₇NO₄
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(=O)CCN1Cc2cc3c(cc2C(O)C1)OCO3
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C14H17NO4/c1-9(16)2-3-15-6-10-4-13-14(19-8-18-13)5-11(10)12(17)7-15/h4-5,12,17H,2-3,6-8H2,1H3
0 references
InChIKey
DOCFTWOBHIMVHN-UHFFFAOYSA-N
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CAS Registry Number
46985-27-7
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478020-05-2
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PubChem CID
280243
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
23579726
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80299637
0 references
DTXSID80963947
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DSSTOX compound identifier
DTXCID30250773
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DTXCID40953864
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NSC number
131699
0 references
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