Compound Identification
SMILES
CC(=O)N[C@H]1[C@@H](OC(=C[C@@H]1N=C(N)N)C(O)=O)[C@H](OC(=O)NCCCCCCNC(=O)CC[C@@H](N)C(=O)NCC(=O)NCCCCCCNC(=O)O[C@H]([C@H](O)CO)[C@@H]1OC(=C[C@H](N=C(N)N)[C@H]1NC(C)=O)C(O)=O)[C@H](O)CO
InChIKey
InChIKey=LRTMBQJLISDNIX-LBVUSRCQSA-N
Formula
C45H76N14O19
Mass
1117.182
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
Glutamine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides N-acyl amines Dicarboxylic acids and derivatives Acetamides Carbamate esters Secondary carboxylic acid amides Secondary alcohols Amino acids Guanidines Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Carboximidamides Carboxylic acids Carbonyl compounds Primary alcohols Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Glutamine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - N-acyl-amine - Fatty amide - Dicarboxylic acid or derivatives - Fatty acyl - Carbamic acid ester - Acetamide - Secondary carboxylic acid amide - Secondary alcohol - Guanidine - Amino acid - Carboxamide group - Amino acid or derivatives - Oxacycle - Carboxylic acid - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alcohol - Carbonyl group - Hydrocarbon derivative - Primary aliphatic amine - Amine - Primary amine - Organonitrogen compound - Organooxygen compound - Primary alcohol - Aliphatic 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