Compound Identification
SMILES
CC[C@H](NC)C(=O)N[C@H]1[C@@H](CO)CC[C@H]2CC[C@H](N2C1=O)C(=O)N[C@H](C1=CN(CCCCC2=CC=C(CCCCN3C=C(N=N3)[C@@H](NC(=O)[C@@H]3CC[C@@H]4CC[C@H](CO)[C@H](NC(=O)[C@H](CC)NC)C(=O)N34)C3=CC=CC=C3)C=C2)N=N1)C1=CC=CC=C1
InChIKey
InChIKey=XKEIDWZKJDOBEL-OKDMWEIPSA-N
Formula
C64H88N14O8
Mass
1181.498
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 Cyclic peptides
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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
Peptides
Direct Parent
Cyclic peptides
Alternative Parents
N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenylbutylamines Pyrroloazepines Caprolactams Pyrrolidinecarboxamides Azepanes N-acyl amines Tertiary carboxylic acid amides Heteroaromatic compounds Triazoles Secondary carboxylic acid amides Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic alpha peptide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylbutylamine - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Pyrroloazepine - Caprolactam - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - Azepane - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Fatty amide - N-acyl-amine - Azole - Heteroaromatic compound - 1,2,3-triazole - Tertiary carboxylic acid amide - Pyrrolidine - Secondary carboxylic acid amide - Lactam - Amino acid or derivatives - Carboxamide group - Secondary amine - Secondary aliphatic amine - Organoheterocyclic compound - Azacycle - Amine - Carbonyl group - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Primary alcohol - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cyclic peptides. These are compounds containing a cyclic moiety bearing a peptide backbone.
External Descriptors
Not available