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(Q105139124)
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English
(1R,9S,10S,12R)-4,5,12-trimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2,4,6-trien-13-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4,5,12-Trimethoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2,4,6-trien-13-one
1 reference
based on heuristic
inferred from SMILES
mass
345.194008344
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₇NO₄
0 references
canonical SMILES
O=C1CC23C4=CC(OC)=C(OC)C=C4CC(N(C)CC2)C3CC1OC
0 references
isomeric SMILES
COc1cc2c(cc1OC)[C@@]13CCN(C)[C@@H](C2)[C@H]1C[C@@H](OC)C(=O)C3
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found in taxon
Stephania zippeliana
1 reference
stated in
Morphinanes isomères originaux isolés de Stephaniazippeliana
Identifiers
InChI
InChI=1S/C20H27NO4/c1-21-6-5-20-11-16(22)17(23-2)10-14(20)15(21)7-12-8-18(24-3)19(25-4)9-13(12)20/h8-9,14-15,17H,5-7,10-11H2,1-4H3/t14-,15+,17-,20+/m1/s1
0 references
InChIKey
KDFCXHYXRVENIS-MJEZEWASSA-N
0 references
PubChem CID
163019760
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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