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(Q104375217)
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English
9-Tigloylplatynecine
group of stereoisomers with the chemical formula C₁₃H₂₁NO₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
pyrrolizidine alkaloid
1 reference
inferred from
pyrrolizidine alkaloid
mass
239.152143532
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₂₁NO₃
0 references
canonical SMILES
O=C(OCC1CCN2CCC(O)C21)C(=CC)C
0 references
isomeric SMILES
C/C=C(\C)C(=O)OC[C@H]1CCN2CC[C@@H](O)C12
0 references
found in taxon
Ipomoea hederifolia
1 reference
stated in
Pyrrolizidine alkaloids of Ipomoea hederifolia and related species
Identifiers
InChI
InChI=1S/C13H21NO3/c1-3-9(2)13(16)17-8-10-4-6-14-7-5-11(15)12(10)14/h3,10-12,15H,4-8H2,1-2H3/b9-3+/t10-,11-,12?/m1/s1
0 references
InChIKey
FOWFFDPFIJUTGG-JUUAVEPRSA-N
0 references
PubChem CID
6428022
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
FOWFFDPFIJUTGG-JUUAVEPRSA-N
UniChem compound ID
42761107
1 reference
stated in
UniChem
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