Compound Identification
SMILES
Cl.CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@H](CC(=O)C1=NC(=CS1)C(=O)N[C@H](C[C@H](C)C(O)=O)CC1=CC=CC=C1)C(C)C
InChIKey
InChIKey=JXJBTOJZDRYEAA-KMODKYMMSA-N
Formula
C33H48ClN5O6S
Mass
678.29
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Isoleucine and derivatives Proline and derivatives N-acyl-alpha amino acids and derivatives Gamma amino acids and derivatives Alpha amino acid amides Amphetamines and derivatives Thiazolecarboxamides Aryl alkyl ketones Pyrrolidinecarboxamides 2-heteroaryl carboxamides Medium-chain fatty acids 2,4-disubstituted thiazoles Heterocyclic fatty acids Methyl-branched fatty acids N-acyl amines Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Isoleucine or derivatives - N-acyl-alpha amino acid or derivatives - Proline or derivatives - Gamma amino acid or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - Medium-chain fatty acid - Aryl ketone - Aryl alkyl ketone - 2-heteroaryl carboxamide - 2,4-disubstituted 1,3-thiazole - Branched fatty acid - Heterocyclic fatty acid - Methyl-branched fatty acid - Fatty acyl - Fatty amide - Monocyclic benzene moiety - Fatty acid - N-acyl-amine - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Pyrrolidine - Secondary carboxylic acid amide - Amino acid - Ketone - Amino acid or derivatives - Carboxamide group - Monocarboxylic acid or derivatives - Secondary amine - Azacycle - Organoheterocyclic compound - Carboxylic acid - Secondary aliphatic amine - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organooxygen compound - Amine - Organic oxide - Hydrochloride - Aromatic heteromonocyclic 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