Compound Identification
SMILES
CC(CC(=O)C(N)CCCN=C(N)N)(C(=O)CN)C(N)(C(O)=O)C(=O)C(N)CC(O)=O
InChIKey
InChIKey=XESUBPXGCDHOTC-UHFFFAOYSA-N
Formula
C17H31N7O7
Mass
445.477
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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Level 5
Amino acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Carboxylic acids and derivatives
Subclass
Amino acids, peptides, and analogues
Intermediate Tree Nodes
Amino acids and derivatives
Direct Parent
Beta amino acids and derivatives
Alternative Parents
Alpha amino acids Medium-chain keto acids and derivatives Gamma-keto acids and derivatives Amino fatty acids Beta-keto acids and derivatives Methyl-branched fatty acids Beta-amino ketones Beta-hydroxy ketones Dicarboxylic acids and derivatives Gamma-amino ketones Alpha-amino ketones Amino acids Guanidines Carboxylic acids Carboximidamides Propargyl-type 1,3-dipolar organic compounds Monoalkylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic acyclic compounds
Substituents
Beta amino acid or derivatives - Alpha-amino acid - Alpha-amino acid or derivatives - Medium-chain keto acid - Gamma-keto acid - Amino fatty acid - Beta-keto acid - Branched fatty acid - Methyl-branched fatty acid - Beta-aminoketone - Beta-hydroxy ketone - Fatty acyl - Dicarboxylic acid or derivatives - Gamma-aminoketone - Keto acid - Alpha-aminoketone - Ketone - Guanidine - Amino acid - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Amine - Primary aliphatic amine - Organonitrogen compound - Organooxygen compound - Primary amine - Aliphatic acyclic compound
Description
This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.
External Descriptors
Not available