Compound Identification
SMILES
OC(=O)C(O)=O.CCCN(CCC)C(=O)C(CC1=CC=C(OCCN(C)C)C=C1)NC(=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=YHASEADFGMOQTE-UHFFFAOYSA-N
Formula
C28H38N4O9
Mass
574.631
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
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
Hippuric acids and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Amphetamines and derivatives Nitrobenzenes Benzoyl derivatives Nitroaromatic compounds Phenoxy compounds Phenol ethers Alkyl aryl ethers Dicarboxylic acids and derivatives Tertiary carboxylic acid amides Trialkylamines Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Organic oxoazanium compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organopnictogen compounds
Molecular Framework
Not available
Substituents
Phenylalanine or derivatives - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - Benzoic acid or derivatives - Nitrobenzene - Benzamide - Phenol ether - Benzoyl - Phenoxy compound - Nitroaromatic compound - Alkyl aryl ether - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid - Ether - Organic oxoazanium - Amine - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic zwitterion - Organooxygen compound - Organonitrogen compound - Organic oxide - 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