Compound Identification
SMILES
CCCCC1=NC(Cl)=C(CO)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN(N=N1)C1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O
InChIKey
InChIKey=NGFMQMUIOUSHGR-JNKBPBDDSA-N
Formula
C28H31ClN6O7
Mass
599.04
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
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Level 5
Sugar acids and derivatives
- Level 6 Glucuronic acid derivatives
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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
Sugar acids and derivatives
Direct Parent
Glucuronic acid derivatives
Alternative Parents
Biphenyls and derivatives Phenyltetrazoles and derivatives 1,2,4,5-tetrasubstituted imidazoles Imidazolyl carboxylic acids and derivatives Beta hydroxy acids and derivatives Oxanes Aryl chlorides Pyrans N-substituted imidazoles Heteroaromatic compounds Secondary alcohols 1,2-diols Monocarboxylic acids and derivatives Oxacyclic compounds Carboxylic acids Azacyclic compounds Primary alcohols Hydrocarbon derivatives Carbonyl compounds Organochlorides Organonitrogen compounds Aromatic alcohols Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Glucuronic acid or derivatives - Biphenyl - Phenyltetrazole - 1,2,4,5-tetrasubstituted imidazole - Imidazolyl carboxylic acid derivative - Beta-hydroxy acid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Hydroxy acid - N-substituted imidazole - Pyran - Oxane - Azole - Heteroaromatic compound - Imidazole - Tetrazole - Secondary alcohol - 1,2-diol - Polyol - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Carbonyl group - Aromatic alcohol - Alcohol - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organonitrogen compound - Primary alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as glucuronic acid derivatives. These are compounds containing a glucuronic acid moiety (or a derivative), which consists of a glucose moiety with the C6 carbon oxidized to a carboxylic acid.
External Descriptors
Not available