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(Q105138809)
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English
(4-Ethyl-18-hydroxy-14,16-dimethoxy-10-methyl-6-oxa-4-azaheptacyclo[15.2.1.02,7.02,11.03,13.05,10.014,19]icosan-12-yl) acetate
group of stereoisomers with the chemical formula C₂₅H₃₇NO₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
aconitane alkaloid
1 reference
inferred from
aconitane alkaloid
mass
447.2620879039999
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₅H₃₇NO₆
0 references
canonical SMILES
O=C(OC1C2C3N(CC)C4OC5CCC4(C)C1C53C6CC7C(OC)CC2(OC)C6C7O)C
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Identifiers
InChI
InChI=1S/C25H37NO6/c1-6-26-21-17-19(31-11(2)27)20-23(3)8-7-15(32-22(23)26)25(20,21)13-9-12-14(29-4)10-24(17,30-5)16(13)18(12)28/h12-22,28H,6-10H2,1-5H3
0 references
InChIKey
KCKWLTSMSXSQHY-UHFFFAOYSA-N
0 references
PubChem CID
162915004
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KCKWLTSMSXSQHY-UHFFFAOYSA-N
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