Compound Identification
SMILES
COC1=CC2=C(C=C1)C(O[C@@H]1C[C@@H]3N(C1)C(=O)[C@H](CCCCC\C=C/[C@@H]1C[C@]1(NC3=O)C(O)=O)NC1=CC=CC=C1)=CC(=N2)C1=CSC(NC(C)C)=N1
InChIKey
InChIKey=NPDDIOQZAYVIMW-IDPGULJKSA-N
Formula
C40H46N6O6S
Mass
738.9
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
Macrolactams Alpha amino acids and derivatives Quinolines and derivatives Aniline and substituted anilines Anisoles Phenylalkylamines Alkyl aryl ethers Secondary alkylarylamines 2,4-disubstituted thiazoles Pyridines and derivatives 2-amino-1,3-thiazoles Cyclopropanecarboxylic acids Pyrrolidines Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Lactams Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Organopnictogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic alpha peptide - Macrolactam - Quinoline - Alpha-amino acid or derivatives - Phenol ether - Aniline or substituted anilines - Phenylalkylamine - Anisole - Alkyl aryl ether - Secondary aliphatic/aromatic amine - 2,4-disubstituted 1,3-thiazole - 1,3-thiazol-2-amine - Pyridine - Cyclopropanecarboxylic acid - Benzenoid - Cyclopropanecarboxylic acid or derivatives - Monocyclic benzene moiety - Pyrrolidine - Thiazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Azole - Amino acid or derivatives - Amino acid - Carboxamide group - Secondary carboxylic acid amide - Lactam - Ether - Organoheterocyclic compound - Azacycle - Carboxylic acid - Secondary amine - Monocarboxylic acid or derivatives - Amine - Organopnictogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - 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