Compound Identification
SMILES
[Na+].[O-]C(=O)c1ccc(CN2CCC(CNC(=O)c3n[nH]c4ccc(Br)cc34)CC2)o1
InChIKey
InChIKey=BJZXFSYKVIJXEL-UHFFFAOYSA-M
Formula
C20H20BrN4NaO4
Mass
483.298
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic oxygen compounds
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Class
Organooxygen compounds
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Subclass
Carbohydrates and carbohydrate conjugates
- Level 5 Sugar acids and derivatives
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Subclass
Carbohydrates and carbohydrate conjugates
-
Class
Organooxygen compounds
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Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Sugar acids and derivatives - Sugar amino acids and derivatives
Direct Parent
Furanoid amino acids and derivatives
Alternative Parents
Indazole-3-carboxamides Pyrazole-5-carboxamides 2-heteroaryl carboxamides Furoic acids Aralkylamines Piperidines Aryl bromides Benzenoids Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids Carboxylic acid salts Oxacyclic compounds Azacyclic compounds Carboxylic acids Organic metal halides Monocarboxylic acids and derivatives Organic sodium salts Organic oxides Organobromides Organic zwitterions Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Furanoid amino acid - Indazole-3-carboxamide - Benzopyrazole - Indazole - 2-heteroaryl carboxamide - Furoic acid or derivatives - Pyrazole-5-carboxamide - Furoic acid - Aralkylamine - Aryl bromide - Aryl halide - Piperidine - Benzenoid - Azole - Furan - Heteroaromatic compound - Pyrazole - Carboxamide group - Carboxylic acid salt - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid - Organic alkali metal salt - Azacycle - Organoheterocyclic compound - Organic metal halide - Carboxylic acid derivative - Oxacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxide - Organic sodium salt - Amine - Organopnictogen compound - Organic zwitterion - Organic nitrogen compound - Hydrocarbon derivative - Organic salt - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as furanoid amino acids and derivatives. These are sugar amino acids containing a furan ring.
External Descriptors
Not available