Compound Identification
SMILES
OC(C(O)C(O)=O)C(O)=O.CN1CCCC1=NC(=NC1=CC=CC=C1)N1CCCC1
InChIKey
InChIKey=POCOFJTXQYWTDN-UHFFFAOYSA-N
Formula
C20H28N4O6
Mass
420.466
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbohydrates and carbohydrate conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Sugar acids and derivatives
Alternative Parents
Short-chain hydroxy acids and derivatives Beta hydroxy acids and derivatives Alpha hydroxy acids and derivatives Benzene and substituted derivatives Dicarboxylic acids and derivatives Fatty acids and conjugates Imidolactams Monosaccharides N-alkylpyrrolidines 1,2-diols Secondary alcohols Azacyclic compounds Carboxylic acids Carboximidamides Carboxamidines Propargyl-type 1,3-dipolar organic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Not available
Substituents
Beta-hydroxy acid - Sugar acid - Short-chain hydroxy acid - Alpha-hydroxy acid - Monocyclic benzene moiety - Fatty acid - Dicarboxylic acid or derivatives - Imidolactam - Hydroxy acid - Monosaccharide - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - 1,2-diol - Secondary alcohol - Amidine - Azacycle - Carboxylic acid amidine - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Hydrocarbon derivative - Alcohol - Carbonyl group - Organonitrogen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as sugar acids and derivatives. These are compounds containing a saccharide unit which bears a carboxylic acid group.
External Descriptors
Not available