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(Q104246548)
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English
1-[(1r,6r)-9-Azabicyclo[4.2.1]non-2-En-2-Yl]ethanone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkaloid
0 references
mass
165.1153641
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
1-(9-Azabicyclo[4.2.1]non-2-en-2-yl)ethan-1-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₅NO
0 references
canonical SMILES
O=C(C1=CCCC2NC1CC2)C
0 references
isomeric SMILES
CC(=O)C1=CCC[C@@H]2CC[C@H]1N2
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found in taxon
Anabaena circinalis
1 reference
stated in
Liquid chromatography/mass spectrometric detection of anatoxin-a, a neurotoxin from cyanobacteria
Oscillatoria
1 reference
stated in
Liquid chromatography/mass spectrometric detection of anatoxin-a, a neurotoxin from cyanobacteria
Microcystis aeruginosa
1 reference
stated in
Liquid chromatography/mass spectrometric detection of anatoxin-a, a neurotoxin from cyanobacteria
Raphidiopsis mediterranea
1 reference
stated in
Simultaneous production of homoanatoxin-a, anatoxin-a, and a new non-toxic 4-hydroxyhomoanatoxin-a by the cyanobacterium Raphidiopsis mediterranea Skuja
Aphanizomenon flosaquae
2 references
stated in
Liquid chromatography/mass spectrometric detection of anatoxin-a, a neurotoxin from cyanobacteria
stated in
Biosynthesis of anatoxin-a in Anabaena flos-aquae and homoanatoxin-a in Oscillatoria formosa
Anabaena
1 reference
stated in
Anatoxin-a, a toxic alkaloid from Anabaena flos-aquae NRC-44h
Dolichospermum circinale
1 reference
stated in
Liquid chromatography/mass spectrometric detection of anatoxin-a, a neurotoxin from cyanobacteria
Identifiers
InChI
InChI=1S/C10H15NO/c1-7(12)9-4-2-3-8-5-6-10(9)11-8/h4,8,10-11H,2-3,5-6H2,1H3/t8-,10-/m1/s1
0 references
InChIKey
SGNXVBOIDPPRJJ-PSASIEDQSA-N
0 references
CAS Registry Number
64285-06-9
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
3034748
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SGNXVBOIDPPRJJ-PSASIEDQSA-N
UniChem compound ID
27309093
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50867064
1 reference
matched by identifier from
InChIKey
InChIKey
SGNXVBOIDPPRJJ-PSASIEDQSA-N
UNII
80023A73NK
1 reference
matched by identifier from
InChIKey
InChIKey
SGNXVBOIDPPRJJ-PSASIEDQSA-N
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