Compound Identification
SMILES
CCC[C@H](NC(=O)[C@@H]1[C@H]2O[C@H]3CCCOC4=CC=CC(CC(=O)N[C@@H](C5CCCCC5)C(=O)N1C[C@@H]2O3)=C4)C(=O)C(=O)NCC(=O)N[C@H](C(=O)OC(C)(C)C)C1=CC=CC=C1
InChIKey
InChIKey=MPYJNZQYNLNYOZ-MHEBPXTKSA-N
Formula
C45H59N5O11
Mass
845.991
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
Dipeptides Alpha amino acid esters N-acyl-alpha amino acids and derivatives Macrolactams Alpha amino acid amides Pyrrolidinecarboxamides Alkyl aryl ethers N-acyl amines Benzene and substituted derivatives Tertiary carboxylic acid amides 1,3-dioxolanes Secondary carboxylic acid amides Lactams Ketones Carboxylic acid esters Oxacyclic compounds Acetals Azacyclic compounds Monocarboxylic acids and derivatives Organonitrogen compounds Organic oxides Aldehydes Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Cyclic alpha peptide - Macrolactam - N-acyl-alpha amino acid or derivatives - Alpha-amino acid ester - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - Alkyl aryl ether - Fatty acyl - Benzenoid - N-acyl-amine - Fatty amide - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Pyrrolidine - Meta-dioxolane - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid ester - Ketone - Lactam - Acetal - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Aldehyde - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxide - 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