Compound Identification
SMILES
COC(=O)[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)OCC1=CC=CC=C1)C1=CC(OC2=C(OC)C=CC(=C2)[C@@H](NC(=O)OC(C)(C)C)C(O)=O)=C(C)C(OC)=C1
InChIKey
InChIKey=AYQSWBHXKVJBFY-GDQCAIRTSA-N
Formula
C42H47N3O12
Mass
785.847
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 Peptides
-
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
Not available
Direct Parent
Peptides
Alternative Parents
Phenylalanine and derivatives Alpha amino acid esters Diphenylethers N-acyl-alpha amino acids and derivatives Alpha amino acid amides Diarylethers Amphetamines and derivatives Benzyloxycarbonyls Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Toluenes Dicarboxylic acids and derivatives Fatty amides Methyl esters Carbamate esters Secondary carboxylic acid amides Carboxylic acids Carbonyl compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alpha peptide - Phenylalanine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Diphenylether - Alpha-amino acid amide - Diaryl ether - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Benzyloxycarbonyl - Phenol ether - Methoxybenzene - Phenoxy compound - Anisole - Toluene - Alkyl aryl ether - Fatty acyl - Benzenoid - Fatty amide - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Carbamic acid ester - Methyl ester - Secondary carboxylic acid amide - Carboxylic acid ester - Carboxamide group - Ether - Carboxylic acid - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - 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