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(Q105121696)
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English
[(1R,2S,4S,9R,10R)-14-oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-4-yl] hexanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkaloid
0 references
mass
362.256942948
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(1R,2R,4S,9R,10S)-14-oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-4-yl] hexanoate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₁H₃₄N₂O₃
0 references
canonical SMILES
O=C(OC1CCN2CC3CC(CN4C(=O)CCCC43)C2C1)CCCCC
0 references
isomeric SMILES
CCCCCC(=O)O[C@H]1CCN2C[C@H]3C[C@H](CN4C(=O)CCC[C@H]34)[C@@H]2C1
0 references
found in taxon
Lupinus angustifolius
1 reference
stated in
New Lupine Alkaloids from the Seedlings of Lupinus hirsutus and Change of Alkaloid Pattern with Germination
Identifiers
InChI
InChI=1S/C21H34N2O3/c1-2-3-4-8-21(25)26-17-9-10-22-13-15-11-16(19(22)12-17)14-23-18(15)6-5-7-20(23)24/h15-19H,2-14H2,1H3/t15-,16-,17+,18-,19+/m1/s1
0 references
InChIKey
IWKSNUCWADZDQR-FQBWVUSXSA-N
0 references
PubChem CID
162872807
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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