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(Q108400956)
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English
CAR-302,282
chemical compound
(1-methylpiperidin-4-yl) 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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chemical structure
CAR302282 structure.png
1,165 × 833; 37 KB
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mass
313.16779359599997
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₃NO₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC(=C)C#CC(C1=CC=CC=C1)(C(=O)OC2CCN(CC2)C)O
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Identifiers
InChI
InChI=1S/C19H23NO3/c1-15(2)9-12-19(22,16-7-5-4-6-8-16)18(21)23-17-10-13-20(3)14-11-17/h4-8,17,22H,1,10-11,13-14H2,2-3H3
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InChIKey
HNFSQQPBCHYZKE-UHFFFAOYSA-N
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CAS Registry Number
62869-67-4
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PubChem CID
44183
1 reference
matched by identifier from
InChIKey
InChIKey
HNFSQQPBCHYZKE-UHFFFAOYSA-N
UniChem compound ID
27242644
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID401337048
1 reference
matched by identifier from
InChIKey
InChIKey
HNFSQQPBCHYZKE-UHFFFAOYSA-N
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CAR-302,282
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