Compound Identification
SMILES
COC(=O)SSC[C@H](NC(=O)OC(C)(C)C)\C=C\CN1C[C@H](C[C@H]1C(=O)N[C@@H](CCSC)C(=O)OC)C1=CC=CC=C1
InChIKey
InChIKey=MMQZMEWEGAUKSY-IBACZEEJSA-N
Formula
C29H43N3O7S3
Mass
641.86
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
Methionine and derivatives Proline and derivatives Alpha amino acid esters N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenylpyrrolidines Pyrrolidinecarboxamides Fatty acid esters Aralkylamines Benzene and substituted derivatives N-alkylpyrrolidines Carbamate esters Pyrroles Methyl esters Trialkylamines Secondary carboxylic acid amides Organic thiocarbonic acid derivatives Organic disulfides Sulfenyl compounds Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Hydrocarbon derivatives Organic oxides Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha peptide - Methionine or derivatives - Alpha-amino acid ester - Proline or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - 3-phenylpyrrolidine - Alpha-amino acid or derivatives - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Aralkylamine - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - N-alkylpyrrolidine - Pyrrole - Methyl ester - Pyrrolidine - Carbamic acid ester - Amino acid or derivatives - Organic disulfide - Carboxylic acid ester - Thiocarbonic acid derivative - Secondary carboxylic acid amide - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Monocarboxylic acid or derivatives - Thioether - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen 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