CHEBI:92413 - 5-[(2,5-dihydroxyphenyl)methyl-[(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoic acid

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ChEBI Name 5-[(2,5-dihydroxyphenyl)methyl-[(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoic acid
ChEBI ID CHEBI:92413
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C21H19NO6
Net Charge 0
Average Mass 381.379
Monoisotopic Mass 381.12124
InChI InChI=1S/C21H19NO6/c23-16-6-8-19(25)14(9-16)12-22(11-13-3-1-2-4-18(13)24)15-5-7-20(26)17(10-15)21(27)28/h1-10,23-26H,11-12H2,(H,27,28)
InChIKey ULTTYPMRMMDONC-UHFFFAOYSA-N
SMILES C1=CC=C(C(=C1)CN(CC2=C(C=CC(=C2)O)O)C3=CC(=C(C=C3)O)C(=O)O)O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 5-[(2,5-dihydroxyphenyl)methyl-[(2-hydroxyphenyl)methyl]amino]-2-hydroxybenzoic acid (CHEBI:92413) is a aromatic amine (CHEBI:33860)
Manual Xref Database
LSM-2514 LINCS
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