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(Q105182277)
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English
2-[(4Z)-hept-4-en-1-yl]-1H-quinolin-4-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
quinoline alkaloid
0 references
mass
241.146664228
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₉NO
0 references
canonical SMILES
O=C1C=C(NC=2C=CC=CC12)CCCC=CCC
0 references
isomeric SMILES
CC/C=C\CCCc1cc(=O)c2ccccc2[nH]1
1 reference
based on heuristic
inferred from InChI
found in taxon
Haplophyllum acutifolium
2 references
stated in
Accelerated dereplication of crude extracts using HPLC-PDA-MS-SPE-NMR: quinolinone alkaloids of Haplophyllum acutifolium
stated in
Accelerated dereplication of crude extracts using HPLC-PDA-MS-SPE-NMR: quinolinone alkaloids of Haplophyllum acutifolium
Identifiers
InChI
InChI=1S/C16H19NO/c1-2-3-4-5-6-9-13-12-16(18)14-10-7-8-11-15(14)17-13/h3-4,7-8,10-12H,2,5-6,9H2,1H3,(H,17,18)/b4-3-
0 references
InChIKey
NNRQRIKGBJBXDO-ARJAWSKDSA-N
0 references
CAS Registry Number
36150-05-7
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
163184322
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NNRQRIKGBJBXDO-ARJAWSKDSA-N
KNApSAcK ID
C00048306
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NNRQRIKGBJBXDO-ARJAWSKDSA-N
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