Compound Identification
SMILES
COC1=C(C)C(C)=C(C(C)=C1)S(=O)(=O)N[C@@H](CC(=O)OC(C)(C)C)C(=O)NC(CC1=CC2=C(C=C1)C(N)=NC=C2)C(=O)N1CCCCC1
InChIKey
InChIKey=PTDUDCRDRXTZTQ-MBMZGMDYSA-N
Formula
C35H47N5O7S
Mass
681.85
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
Aspartic acid and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzenesulfonamides Isoquinolines and derivatives Benzenesulfonyl compounds N-acylpiperidines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Fatty acid esters Aminopyridines and derivatives Imidolactams N-acyl amines Organosulfonamides Aminosulfonyl compounds Heteroaromatic compounds Tertiary carboxylic acid amides Secondary carboxylic acid amides Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Primary amines Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Aspartic acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzenesulfonamide - Isoquinoline - Benzenesulfonyl group - N-acyl-piperidine - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Fatty acid ester - Aminopyridine - Alkyl aryl ether - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Imidolactam - N-acyl-amine - Benzenoid - Piperidine - Pyridine - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Heteroaromatic compound - Tertiary carboxylic acid amide - Amino acid or derivatives - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Ether - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Primary amine - Organosulfur compound - Amine - Carbonyl group - Organic oxide - Organooxygen compound - Organonitrogen 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