Compound Identification
SMILES
CC1=C(C=CC(=C1)N1CCC(NC(=O)C2(CCCCC2)NC(=O)C2=CC3=CC=CC=C3O2)C(=O)C1)[N+]([O-])=O
InChIKey
InChIKey=MCCHGROZOKAADB-UHFFFAOYSA-N
Formula
C28H30N4O6
Mass
518.57
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
-
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
N-acyl-alpha amino acids and derivatives
Alternative Parents
Phenylpiperidines Benzofurans Nitrotoluenes Nitrobenzenes 2-heteroaryl carboxamides Aminotoluenes Aniline and substituted anilines Dialkylarylamines Furoic acid and derivatives Nitroaromatic compounds Piperidinones Heteroaromatic compounds Secondary carboxylic acid amides Cyclic ketones Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Oxacyclic compounds Organic salts Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Phenylpiperidine - Benzofuran - Nitrobenzene - Nitrotoluene - 2-heteroaryl carboxamide - Tertiary aliphatic/aromatic amine - Furoic acid or derivatives - Nitroaromatic compound - Dialkylarylamine - Aniline or substituted anilines - Aminotoluene - Toluene - Piperidinone - Piperidine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Furan - C-nitro compound - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Cyclic ketone - Ketone - Organic nitro compound - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic nitrogen compound - Amine - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available