Compound Identification
SMILES
OC1OC(=O)C[C@@H]1NC(=O)[C@@H]1CC[C@@H]2CC=CC[C@H](NC(=O)C3=CC=CC=C3)C(=O)N12
InChIKey
InChIKey=MMHJXSXOWZFGSK-VBASKTGHSA-N
Formula
C22H25N3O6
Mass
427.457
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
Dipeptides N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzamides Pyrrolidinecarboxamides Benzoyl derivatives Gamma butyrolactones Tertiary carboxylic acid amides Oxolanes Secondary carboxylic acid amides Carboxylic acid esters Hemiacetals Lactams Azacyclic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organonitrogen compounds Carbonyl compounds Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Cyclic alpha peptide - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Benzamide - Benzoic acid or derivatives - Benzoyl - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - Monocyclic benzene moiety - Gamma butyrolactone - Benzenoid - Tertiary carboxylic acid amide - Pyrrolidine - Oxolane - Carboxamide group - Carboxylic acid ester - Hemiacetal - Lactam - Lactone - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen 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