Compound Identification
SMILES
COC(=O)N[C@@H](C(=O)N1CCC[C@H]1C(=O)Nc1cccc(OS(=O)(=O)Oc2cccc(NC(=O)[C@@H]3CCCN3C(=O)[C@H](NC(=O)OC)c3ccccc3)c2C)c1C)c1ccccc1
InChIKey
InChIKey=DLQUKYHVGQCQCY-QXOULVPSSA-N
Formula
C44H48N6O12S
Mass
884.96
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
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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
Proline and derivatives Alpha amino acid amides Phenylacetamides Arylsulfates Methoxyanilines Anilides Pyrrolidinecarboxamides Phenoxy compounds N-arylamides N-acylpyrrolidines Sulfuric acid diesters N-acyl amines Tertiary carboxylic acid amides Methylcarbamates Organic carbonic acids and derivatives Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Proline or derivatives - Alpha-amino acid amide - Arylsulfate - Phenylacetamide - Alpha-amino acid or derivatives - Methoxyaniline - Anilide - Phenoxy compound - N-arylamide - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - N-acylpyrrolidine - Sulfuric acid diester - Fatty acyl - Benzenoid - Sulfuric acid ester - N-acyl-amine - Fatty amide - Monocyclic benzene moiety - Methylcarbamate - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Organic sulfuric acid or derivatives - Carbonic acid derivative - Carboxamide group - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - 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