Compound Identification
SMILES
COC(=O)C1C\C=C\CC2=CC3=CC=CC=C3C(=C2OC)C2=C(OC)C(CC(NC(C)=O)C(=O)NC(CCCCN)C(=O)N1)=CC1=CC=CC=C21
InChIKey
InChIKey=UBNYPKYJUMLTEM-JXMROGBWSA-N
Formula
C40H46N4O7
Mass
694.829
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
-
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
Cyclic peptides
Alternative Parents
Alpha amino acid esters Macrolactams N-acyl-alpha amino acids and derivatives Naphthalenes Anisoles Alkyl aryl ethers Acetamides Methyl esters Lactams Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic alpha peptide - Alpha-amino acid ester - Macrolactam - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Naphthalene - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Methyl ester - Acetamide - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Lactam - Azacycle - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Primary amine - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Organic oxide - Amine - Primary aliphatic amine - 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