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(Q105350798)
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English
Asiaticumine A
group of stereoisomers with the chemical formula C₁₆H₁₃NO₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
alkaloid
1 reference
inferred from
alkaloid
mass
283.084457896
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₆H₁₃NO₄
0 references
canonical SMILES
OCC(O)C1=CC=CC2=C1N=CC3=CC=4OCOC4C=C32
0 references
Identifiers
InChI
InChI=1S/C16H13NO4/c18-7-13(19)11-3-1-2-10-12-5-15-14(20-8-21-15)4-9(12)6-17-16(10)11/h1-6,13,18-19H,7-8H2
0 references
InChIKey
YMXGETAKQNEFRX-UHFFFAOYSA-N
0 references
PubChem CID
102599346
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YMXGETAKQNEFRX-UHFFFAOYSA-N
ChEBI ID
182796
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C16H13NO4/c18-7-13(19)11-3-1-2-10-12-5-15-14(20-8-21-15)4-9(12)6-17-16(10)11/h1-6,13,18-19H,7-8H2
UniChem compound ID
96857026
1 reference
stated in
UniChem
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