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(Q104909865)
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English
15-Hydroxy-5,15-dimethyl-7-oxa-10-azaheptacyclo[12.6.2.01,11.05,20.06,10.012,17.017,21]docosan-19-one
group of stereoisomers with the chemical formula C₂₂H₃₁NO₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
atidane / atisine / hetisan type alkaloid
1 reference
inferred from
atidane / atisine / hetisan type alkaloid
mass
357.230393852
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₁NO₃
0 references
canonical SMILES
O=C1CC23CC(O)(C)C4CC3C5N6CCOC6C7(C)CCCC5(C17)C2C4
0 references
found in taxon
Spiraea japonica
1 reference
stated in
The structures of spirasine V and spirasine VI
Identifiers
InChI
InChI=1S/C22H31NO3/c1-19-4-3-5-22-15-9-12-8-13(17(22)23-6-7-26-18(19)23)21(15,11-20(12,2)25)10-14(24)16(19)22/h12-13,15-18,25H,3-11H2,1-2H3
0 references
InChIKey
ADWWSTLDHHDKTM-UHFFFAOYSA-N
0 references
PubChem CID
78407245
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ADWWSTLDHHDKTM-UHFFFAOYSA-N
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