Compound Identification
SMILES
CC[C@H](C)[C@H](NC(=O)C1=C(C(C#N)=C(SC(C)C)S1)C1=CC=CC=C1)C(=O)N[C@@H](CCSC)C(=O)OC
InChIKey
InChIKey=SPTLWHSXSJPVOM-XJABCFGWSA-N
Formula
C27H35N3O4S3
Mass
561.77
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
- 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
Isoleucine and derivatives Methionine and derivatives Alpha amino acid esters N-acyl-alpha amino acids and derivatives Alpha amino acid amides 2-heteroaryl carboxamides Thiophene carboxamides Alkylarylthioethers Fatty acid esters N-acyl amines Benzene and substituted derivatives Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Sulfenyl compounds Dialkylthioethers Monocarboxylic acids and derivatives Nitriles Carbonyl compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha peptide - Isoleucine or derivatives - Methionine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 2-heteroaryl carboxamide - Aryl thioether - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Fatty acid ester - Alkylarylthioether - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Methyl ester - Thiophene - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Thioether - Sulfenyl compound - Dialkylthioether - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Cyanide - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic 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