Compound Identification
SMILES
COC(=O)C(NC(=O)C(CC1=CC=C(OC2=C(C=C(C=C2)[N+]([O-])=O)[N+]([O-])=O)C=C1)NC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C(C)C
InChIKey
InChIKey=RZEQTKISYDIZLJ-UHFFFAOYSA-N
Formula
C27H26N6O12
Mass
626.535
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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 Peptides
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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
Not available
Direct Parent
Peptides
Alternative Parents
Phenylalanine and derivatives Valine and derivatives Alpha amino acid esters Dinitroanilines Diphenylethers N-acyl-alpha amino acids and derivatives Alpha amino acid amides Diarylethers Amphetamines and derivatives Nitrobenzenes Phenylalkylamines Phenoxy compounds Phenol ethers Nitroaromatic compounds Fatty acid esters Secondary alkylarylamines Fatty amides Methyl esters Secondary carboxylic acid amides Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic zwitterions Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha peptide - Phenylalanine or derivatives - Alpha-amino acid ester - Valine or derivatives - Diphenylether - N-acyl-alpha amino acid or derivatives - Dinitroaniline - Alpha-amino acid amide - Diaryl ether - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Phenylalkylamine - Phenol ether - Aniline or substituted anilines - Aralkylamine - Secondary aliphatic/aromatic amine - Fatty acid ester - Fatty acyl - Benzenoid - Monocyclic benzene moiety - Fatty amide - Methyl ester - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Secondary amine - Ether - Organic oxoazanium - Monocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organic oxide - Organic zwitterion - Organonitrogen compound - Amine - Organopnictogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.
External Descriptors
Not available