Compound Identification
SMILES
CCC(C)C(NC(=O)C1CCCCN1C)C(=O)N(COC(=O)CC(C)C)C(CC(OC(C)=O)C1=NC(C(N)S1)C(=O)NC(CC(C)C(O)=O)CC1=CC=CC=C1)C(C)C
InChIKey
InChIKey=CXZUZUBFXPEDED-UHFFFAOYSA-N
Formula
C43H68N6O9S
Mass
845.11
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
Isoleucine and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Gamma amino acids and derivatives Beta amino acids and derivatives Amphetamines and derivatives Tricarboxylic acids and derivatives Piperidinecarboxamides Thiazolecarboxamides Fatty acid esters N-acyl amines Thiazolines Tertiary carboxylic acid amides Trialkylamines Amino acids Secondary carboxylic acid amides Carboxylic acid esters Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Azacyclic compounds Thiohemiaminal derivatives Carbonyl compounds Organopnictogen compounds Hydrocarbon derivatives Organic oxides Monoalkylamines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-dipeptide - Isoleucine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Gamma amino acid or derivatives - Beta amino acid or derivatives - Alpha-amino acid or derivatives - Amphetamine or derivatives - 2-piperidinecarboxamide - Piperidinecarboxamide - Tricarboxylic acid or derivatives - Thiazolecarboxamide - Fatty acid ester - Fatty acyl - Benzenoid - Piperidine - Monocyclic benzene moiety - N-acyl-amine - Tertiary carboxylic acid amide - Meta-thiazoline - Thiazole - Tertiary amine - Secondary carboxylic acid amide - Tertiary aliphatic amine - Carboxylic acid ester - Amino acid or derivatives - Amino acid - Carboxamide group - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Carboxylic acid - Propargyl-type 1,3-dipolar organic compound - Hemithioaminal - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Primary aliphatic amine - 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