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(Q72515438)
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English
6-(4-Carboxyanilino)-4-hydroxy-2-naphthalenesulfonic acid
chemical compound
4-Carboxyphenyl-gamma-acid
4-[(8-Hydroxy-6-sulfo-2-naphthalenyl)amino]benzoic acid
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Statements
instance of
type of chemical entity
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subclass of
chemical compound
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mass
359.046358136
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₁₃NO₆S
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canonical SMILES
C1=CC(=CC=C1C(=O)O)NC2=CC3=C(C=C(C=C3C=C2)S(=O)(=O)O)O
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Identifiers
InChI
InChI=1S/C17H13NO6S/c19-16-9-14(25(22,23)24)7-11-3-6-13(8-15(11)16)18-12-4-1-10(2-5-12)17(20)21/h1-9,18-19H,(H,20,21)(H,22,23,24)
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InChIKey
DRPVWDDGKRHPKB-UHFFFAOYSA-N
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CAS Registry Number
5855-84-5
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PubChem CID
15219616
1 reference
matched by identifier from
InChIKey
InChIKey
DRPVWDDGKRHPKB-UHFFFAOYSA-N
UniChem compound ID
27078345
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10974107
1 reference
matched by identifier from
InChIKey
InChIKey
DRPVWDDGKRHPKB-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID301401543
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