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(Q104982206)
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English
7-amino-6-(3,7-dimethylocta-2,6-dienyl)-1,1-dioxo-3,4-dihydro-2H-1lambda6,4-benzothiazine-5,8-dione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
alkaloid
0 references
mass
364.145678248
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₄N₂O₄S
0 references
canonical SMILES
O=C1C=2NCCS(=O)(=O)C2C(=O)C(N)=C1CC=C(C)CCC=C(C)C
0 references
found in taxon
Aplidium conicum
1 reference
stated in
Isolation and Structure Determination of Aplidinones A-C from the Mediterranean AscidianAplidium conicum: A Successful Regiochemistry Assignment by Quantum Mechanical13C NMR Chemical Shift Calculations
Identifiers
InChI
InChI=1S/C18H24N2O4S/c1-11(2)5-4-6-12(3)7-8-13-14(19)17(22)18-15(16(13)21)20-9-10-25(18,23)24/h5,7,20H,4,6,8-10,19H2,1-3H3
0 references
InChIKey
DJHHKWSCPIBQME-UHFFFAOYSA-N
0 references
PubChem CID
73060483
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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