Compound Identification
SMILES
COC(OC)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNC(=O)C1=CC=C(C=C1)C(=O)OCC1=CC=CC=C1)NS(=O)(=O)C12CC3CC(CC(C3)C1)C2)C(C)C
InChIKey
InChIKey=VPUVHACUQZDMKY-KMIXAJQFSA-N
Formula
C43H60N4O9S
Mass
809.03
Taxonomic Classification
Taxonomy Tree
-
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
Proline and derivatives Alpha amino acid amides Benzoic acid esters Benzyloxycarbonyls Benzamides Pyrrolidinecarboxamides N-acylpyrrolidines Benzoyl derivatives Organosulfonamides Organic sulfonamides Tertiary carboxylic acid amides Aminosulfonyl compounds Secondary carboxylic acid amides Carboxylic acid esters Acetals Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Proline or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzoate ester - Benzyloxycarbonyl - Benzamide - Benzoic acid or derivatives - Benzoyl - N-acylpyrrolidine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid amide - Sulfonyl - Tertiary carboxylic acid amide - Aminosulfonyl compound - Organosulfonic acid or derivatives - Pyrrolidine - Organic sulfonic acid or derivatives - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Acetal - Azacycle - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organopnictogen compound - Organooxygen compound - Organosulfur 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