Compound Identification
SMILES
CCN(CCOC(=O)CCC(=O)N1C[C@@H](NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)C2=CC3=CC(=C2)C(=O)N[C@@H]2CCCCC2NC(=O)C2=CC=CC(=C2)C(=O)N[C@@H]2CCCCC2NC3=O)[C@@H](C1)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)C1=CC2=CC(=C1)C(=O)NC1CCCC[C@H]1NC(=O)C1=CC=CC(=C1)C(=O)NC1CCCC[C@H]1NC2=O)C1=CC=C(C=C1)N=NC1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=VLZJJJOTSOAYSN-XSWSKQBVSA-N
Formula
C100H109N17O17
Mass
1821.074
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
-
Level 6
Alpha amino acids and derivatives
-
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
Azobenzenes Macrolactams N-acyl-alpha amino acids and derivatives Alpha amino acid amides Amphetamines and derivatives Nitrobenzenes Dialkylarylamines Aniline and substituted anilines Nitroaromatic compounds N-acylpyrrolidines Fatty acid esters Fatty amides Tertiary carboxylic acid amides Lactams Secondary carboxylic acid amides Carboxylic acid esters Azo compounds Organic oxoazanium compounds Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylalanine or derivatives - Azobenzene - Macrolactam - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - Nitrobenzene - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - N-acylpyrrolidine - Fatty acid ester - Monocyclic benzene moiety - Benzenoid - Fatty acyl - Fatty amide - Pyrrolidine - Tertiary carboxylic acid amide - Azo compound - Carboxamide group - Carboxylic acid ester - Lactam - Organic nitro compound - C-nitro compound - Secondary carboxylic acid amide - Tertiary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic zwitterion - Organic nitrogen compound - Amine - Organooxygen compound - Organic salt - Organic oxide - Organonitrogen compound - Aromatic heteropolycyclic 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