Compound Identification
SMILES
COC(=O)[C@@H](CC1=CC=CC=C1OC)NC1=C(C=C(C(N[C@@H](C)C(N)=O)=C1)[N+]([O-])=O)[N+]([O-])=O
InChIKey
InChIKey=FIGKDYYFTFQGKO-XHDPSFHLSA-N
Formula
C20H23N5O8
Mass
461.431
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Phenylalanine and derivatives
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Level 6
Alpha 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 - Alpha amino acids and derivatives
Direct Parent
Phenylalanine and derivatives
Alternative Parents
Dinitroanilines Alpha amino acid esters Alpha amino acid amides Alanine and derivatives Amphetamines and derivatives Nitrobenzenes Phenoxy compounds Anisoles Nitroaromatic compounds Methoxybenzenes Phenylalkylamines Alkyl aryl ethers Fatty acid esters Secondary alkylarylamines Methyl esters Primary carboxylic acid amides Organic oxoazanium compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenylalanine or derivatives - Alpha-amino acid ester - Dinitroaniline - Alpha-amino acid amide - Alanine or derivatives - Amphetamine or derivatives - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Methoxybenzene - Phenylalkylamine - Aniline or substituted anilines - Anisole - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Fatty acid ester - Aralkylamine - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Methyl ester - Carboxylic acid ester - Primary carboxylic acid amide - C-nitro compound - Carboxamide group - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Ether - Monocarboxylic acid or derivatives - Secondary amine - Organic oxoazanium - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Organic zwitterion - Hydrocarbon derivative - Organic salt - Organooxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available