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(Q104932518)
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English
21-Hydroxy-5,15-dimethyl-7-oxa-10-azaheptacyclo[12.6.2.01,11.05,20.06,10.012,17.017,21]docos-15-en-19-one
group of stereoisomers with the chemical formula C₂₂H₂₉NO₃
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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
355.21474378799996
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₂₉NO₃
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canonical SMILES
O=C1CC23C=C(C)C4CC3C5N6CCOC6C7(C)CCCC5(C17)C2(O)C4
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Identifiers
InChI
InChI=1S/C22H29NO3/c1-12-9-20-11-15(24)16-19(2)4-3-5-21(16)17(23-6-7-26-18(19)23)14(20)8-13(12)10-22(20,21)25/h9,13-14,16-18,25H,3-8,10-11H2,1-2H3
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InChIKey
BDYVYNKEWLPLCY-UHFFFAOYSA-N
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CAS Registry Number
106777-13-3
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
4481793
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
46891939
1 reference
stated in
UniChem
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