Compound Identification
SMILES
[H]C(C)(N)C(O)=NC([H])(CO)C(O)=NC([H])(CC(O)=N)C(O)=NC([H])(CCC(O)=O)C(O)=NC([H])(CC(O)=N)C(O)=NC([H])(CC1=CNC2=CC=CC=C12)C(O)=NC([H])(CCC(O)=O)C(O)=NC([H])(C(O)=NC([H])(CCSC)C(O)=O)C([H])(C)O
InChIKey
InChIKey=XIBKYGCTCNFBFL-UHFFFAOYSA-N
Formula
C44H64N12O18S
Mass
1081.12
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Peptides
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Subclass
Amino acids, peptides, and analogues
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Class
Carboxylic acids and derivatives
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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
Not available
Direct Parent
Peptides
Alternative Parents
N-acyl-alpha amino acids 3-alkylindoles Tricarboxylic acids and derivatives Thia fatty acids Hydroxy fatty acids Substituted pyrroles Benzenoids Heteroaromatic compounds Secondary alcohols Amino acids Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Carboximidic acids Carboxylic acids Dialkylthioethers Carbonyl compounds Primary alcohols Organic oxides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha peptide - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - Tricarboxylic acid or derivatives - Hydroxy fatty acid - Thia fatty acid - Fatty acyl - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Pyrrole - Secondary alcohol - Amino acid or derivatives - Amino acid - Organic 1,3-dipolar compound - Thioether - Dialkylthioether - Organoheterocyclic compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Azacycle - Carboximidic acid - Carboximidic acid derivative - Carboxylic acid - Organic nitrogen compound - Hydrocarbon derivative - Primary aliphatic amine - Alcohol - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Carbonyl group - Primary alcohol - Amine - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.
External Descriptors
Not available