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(Q115965674)
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English
ZIOJAIZLNKYUML-NSHDSACASA-O
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
388.09011689209
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₁₆N₂O₈⁺
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
O=C(O)[C]1C=C(C=C[N+]=2C=3C=C(O)C(O)=CC3CC2C(=O)O)CC(N1)C(=O)O
0 references
isomeric SMILES
O=C(O)[C]1C=C(C=C[N+]2=C(C(=O)O)Cc3cc(O)c(O)cc32)C[C@@H](C(=O)O)N1
0 references
found in taxon
Spinacia oleracea
1 reference
stated in
Detection of betacyanin in red-tube spinach (Spinacia oleracea) and its biofortification by strategic hydroponics
Identifiers
InChI
InChI=1S/C18H15N2O8/c21-14-6-9-5-13(18(27)28)20(12(9)7-15(14)22)2-1-8-3-10(16(23)24)19-11(4-8)17(25)26/h1-3,6-7,11,19H,4-5H2,(H4-,21,22,23,24,25,26,27,28)/p+1/t11-/m0/s1
0 references
InChIKey
ZIOJAIZLNKYUML-NSHDSACASA-O
0 references
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