CHEBI:105203 - 3-[[3-(4-morpholinyl)-1,4-dioxo-2-naphthalenyl]amino]benzoic acid

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ChEBI Name 3-[[3-(4-morpholinyl)-1,4-dioxo-2-naphthalenyl]amino]benzoic acid
ChEBI ID CHEBI:105203
Stars This entity has been manually annotated by a third party.
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Formulae C21H18N2O5
C21H18N2O5
Net Charge 0
Average Mass 378.379
Monoisotopic Mass 378.12157
InChI InChI=1S/C21H18N2O5/c24-19-15-6-1-2-7-16(15)20(25)18(23-8-10-28-11-9-23)17(19)22-14-5-3-4-13(12-14)21(26)27/h1-7,12,22H,8-11H2,(H,26,27)
InChIKey RKRRTHBMNDJIQQ-UHFFFAOYSA-N
SMILES C1COCCN1C2=C(C(=O)C3=CC=CC=C3C2=O)NC4=CC=CC(=C4)C(=O)O
ChEBI Ontology
Outgoing 3-[[3-(4-morpholinyl)-1,4-dioxo-2-naphthalenyl]amino]benzoic acid (CHEBI:105203) is a 1,4-naphthoquinones (CHEBI:132142)
Manual Xref Database
LSM-16566 LINCS
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Last Modified
07 June 2016