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(Q104398919)
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English
Acosmine
group of stereoisomers with the chemical formula C₂₁H₃₃N₃O₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
359.257277296
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₃N₃O₂
0 references
canonical SMILES
C=CCC1C2CC3CN1C1CCC(=CNC(C)=O)C2N1C3CCCCO
0 references
isomeric SMILES
C=CCC1C2CC3CN1C1CC/C(=C\NC(C)=O)C2N1C3CCCCO
0 references
found in taxon
Leptolobium panamense
1 reference
stated in
Computer-assisted structural elucidation. Alkaloids with a novel diaza-adamantane skeleton from the seeds of Acosmium panamense (Fabaceae)
Identifiers
InChI
InChI=1S/C21H33N3O2/c1-3-6-19-17-11-16-13-23(19)20-9-8-15(12-22-14(2)26)21(17)24(20)18(16)7-4-5-10-25/h3,12,16-21,25H,1,4-11,13H2,2H3,(H,22,26)/b15-12+
0 references
InChIKey
AJLGFIUHZYHQNA-NTCAYCPXSA-N
0 references
PubChem CID
101037166
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
AJLGFIUHZYHQNA-NTCAYCPXSA-N
UniChem compound ID
96891530
1 reference
stated in
UniChem
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