Compound Identification
SMILES
CCOCOCC(CC(COCC#C)C(O)=O)NC(=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=NCDGTAQNADSAHB-UHFFFAOYSA-N
Formula
C19H24N2O8
Mass
408.407
Taxonomic Classification
Taxonomy Tree
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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
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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
Gamma amino acids and derivatives
Alternative Parents
Benzamides Nitrobenzenes Benzoyl derivatives Nitroaromatic compounds Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Acetals Acetylides Organic oxoazanium compounds Carboxylic acids Monocarboxylic acids and derivatives Dialkyl ethers Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic salts Organic zwitterions Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Gamma amino acid or derivatives - Benzamide - Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Monocyclic benzene moiety - Benzenoid - C-nitro compound - Organic nitro compound - Carboxamide group - Secondary carboxylic acid amide - Allyl-type 1,3-dipolar organic compound - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Dialkyl ether - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Acetylide - Monocarboxylic acid or derivatives - Acetal - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic salt - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom.
External Descriptors
Not available