Compound Identification
SMILES
NCCCC[C@H](NC(=O)[C@@H]1C[C@H](CN1C(=O)[C@@H](CCC1=CC=CC=C1)NC(=O)OCC1=CC=CC=C1)OC(=O)N1CCCCC1)C(=O)C1=NC2=CC=CC=C2O1
InChIKey
InChIKey=ZBRUNAGWGYBCPZ-QFGDGPJGSA-N
Formula
C42H50N6O8
Mass
766.896
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
-
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 Benzyloxycarbonyls Benzoxazoles Piperidinecarboxylic acids N-acylpyrrolidines Aryl alkyl ketones Pyrrolidinecarboxamides Oxazoles Heteroaromatic compounds Carbamate esters Tertiary carboxylic acid amides Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Proline or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzyloxycarbonyl - Benzoxazole - Piperidinecarboxylic acid - N-acylpyrrolidine - Aryl alkyl ketone - Aryl ketone - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Piperidine - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Oxazole - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrolidine - Ketone - Carboxamide group - Amino acid or derivatives - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Primary aliphatic amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen 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