Compound Identification
SMILES
CNC(CCCN=C(N)N[N+]([O-])=O)C(O)C(=O)NCCC1=CC=CC=C1
InChIKey
InChIKey=NPDXNRMWNVEKPY-UHFFFAOYSA-N
Formula
C16H26N6O4
Mass
366.422
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
- Level 6 Beta amino acids and derivatives
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Level 5
Amino acids and derivatives
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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
Nitroguanidines N-acyl amines Monosaccharides Benzene and substituted derivatives Nitramines Secondary carboxylic acid amides Secondary alcohols Propargyl-type 1,3-dipolar organic compounds Dialkylamines Carboximidamides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Beta amino acid or derivatives - Nitroguanidine - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Monosaccharide - N-acyl-amine - Benzenoid - Nitramine - Carboxamide group - Organic nitro compound - Guanidine - Secondary alcohol - Secondary carboxylic acid amide - Secondary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Carboximidamide - Amine - Organic salt - Hydrocarbon derivative - Alcohol - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic oxygen compound - Carbonyl group - Aromatic homomonocyclic 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