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(Q59944696)
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English
(+)-Myrmicarin 237B
chemical compound
rac-Myrmicarin 237B
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No label defined
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Statements
instance of
type of chemical entity
0 references
subclass of
indolizidine alkaloid
0 references
3‐butyl‐5‐(1‐oxopropyl)indolizidine
0 references
mass
237.209264484
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
1-[(3S,5S,8aS)-3-butyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]propan-1-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3R,5S,9R)‐3‐butyl‐5‐(1‐oxopropyl)indolizidine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
1-[(3S,5R,8aS)-3-butyl-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]propan-1-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₇NO
0 references
canonical SMILES
O=C(CC)C1N2C(CCCC)CCC2CCC1
0 references
isomeric SMILES
CCCC[C@@H]1CC[C@@H]2N1[C@H](CCC2)C(=O)CC
0 references
found in taxon
Myrmicaria natalensis eumenoides
1 reference
stated in
New alkaloids from ants: Identification and synthesis of (3R,5S,9R)-3-butyl-5-(1-oxopropyl)indolizidine and (3R,5R,9R)-3-butyl-5-(1-oxopropyl)indolizidine, constituents of the poison gland secretion in Myrmicaria eumenoides (hymenoptera, formicidae)
Myrmicaria natalensis
1 reference
stated in
New alkaloids from ants: Identification and synthesis of (3R,5S,9R)-3-butyl-5-(1-oxopropyl)indolizidine and (3R,5R,9R)-3-butyl-5-(1-oxopropyl)indolizidine, constituents of the poison gland secretion in Myrmicaria eumenoides (hymenoptera, formicidae)
Identifiers
InChI
InChI=1S/C15H27NO/c1-3-5-7-12-10-11-13-8-6-9-14(16(12)13)15(17)4-2/h12-14H,3-11H2,1-2H3/t12-,13-,14-/m1/s1
0 references
InChIKey
PFXVWWBJFCZGFF-MGPQQGTHSA-N
0 references
PubChem CID
10879158
1 reference
matched by identifier from
InChIKey
InChIKey
PFXVWWBJFCZGFF-MGPQQGTHSA-N
UniChem compound ID
32174915
1 reference
stated in
UniChem
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