Compound Identification
SMILES
COc1cc(\C=C2/S\C(=N/c3ccccc3)N(C(CCCN)C(=O)N[C@H](CC3CNc4ccccc34)C(N)=O)C2=O)cc(OC)c1O
InChIKey
InChIKey=DIPZDNNVJKTBJF-WYNRCGGPSA-N
Formula
C34H38N6O6S
Mass
658.77
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
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Level 5
Peptides
- Level 6 Dipeptides
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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
Peptides
Direct Parent
Dipeptides
Alternative Parents
N-acyl-alpha amino acids and derivatives Dimethoxybenzenes Methoxyphenols Indolines Anisoles Phenoxy compounds Alkyl aryl ethers Secondary alkylarylamines Aralkylamines N-acyl amines Thiazolidines Secondary carboxylic acid amides Primary carboxylic acid amides Isothioureas Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Carbonyl compounds Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - N-acyl-alpha amino acid or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - M-dimethoxybenzene - Dimethoxybenzene - Methoxyphenol - Indole or derivatives - Dihydroindole - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aralkylamine - Phenol - Secondary aliphatic/aromatic amine - Benzenoid - Monocyclic benzene moiety - Fatty amide - Fatty acyl - N-acyl-amine - Thiazolidine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Primary carboxylic acid amide - Isothiourea - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Ether - Secondary amine - Primary aliphatic amine - Hydrocarbon derivative - Primary amine - Carbonyl group - Amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
External Descriptors
Not available