Compound Identification
SMILES
[2H]C1([2H])OC2(C[C@H](N(C2)C(=O)[C@@H](NC(=O)OC)C(C)C)C2=NC=C(N2)C2=CC=C(C=C2)C2=CC=C(C=C2)C2=CN=C(N2)C2CCCN2C(=O)C(NC(=O)OC)C(C)C)OC1([2H])[2H]
InChIKey
InChIKey=YMCAVGXTSCNFDE-RONGGPGZSA-N
Formula
C42H52N8O8
Mass
800.95
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
Valine and derivatives Alpha amino acid amides Biphenyls and derivatives Phenylimidazoles N-acylpyrrolidines Ketals Tertiary carboxylic acid amides 1,3-dioxolanes Methylcarbamates Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic alpha peptide - Valine or derivatives - Alpha-amino acid amide - Biphenyl - 5-phenylimidazole - 4-phenylimidazole - Alpha-amino acid or derivatives - N-acylpyrrolidine - Ketal - Monocyclic benzene moiety - Benzenoid - Meta-dioxolane - Methylcarbamate - Azole - Imidazole - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Carbamic acid ester - Carboxamide group - Oxacycle - Acetal - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - 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