Compound Identification
SMILES
COC(=O)C1=CC(N=[N+]=[N-])C(NC=C=O)C(O1)C(O)C(O)CO
InChIKey
InChIKey=ZREQVKBISRMOML-UHFFFAOYSA-N
Formula
C12H16N4O7
Mass
328.281
Taxonomic Classification
Taxonomy Tree
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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
Sugar acids and derivatives - Sugar amino acids and derivatives
Direct Parent
Pyranoid amino acids and derivatives
Alternative Parents
1,3-aminoalcohols Methyl esters Enoate esters Secondary alcohols 1,2-diols Azo compounds Azo imides Ynolates Oxacyclic compounds Monocarboxylic acids and derivatives Dialkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides Organic salts Organic zwitterions Primary alcohols
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Pyranoid amino acid - 1,3-aminoalcohol - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - 1,2-diol - Azo compound - Carboxylic acid ester - Azo imide - Secondary alcohol - Ynolate - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Polyol - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organonitrogen compound - Primary alcohol - Organic zwitterion - Carbonyl group - Organic salt - Hydrocarbon derivative - Amine - Alcohol - Organic oxide - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyranoid amino acids and derivatives. These are compounds containing a (hydro)pyran ring bearing unprotected amino and carboxylic acid functionalities.
External Descriptors
Not available