Compound Identification
SMILES
COC1=CC2=CC(=NC(O[C@@H]3C[C@@H]4N(C3)C(=O)[C@H](CSCCC\C=C/[C@@H]3C[C@]3(NC4=O)C(=O)NS(=O)(=O)C3CC3)NC(=O)OC(C)(C)C)=C2C=C1)C1=CC=C(OC(F)(F)F)C=C1
InChIKey
InChIKey=LIYQUVWAAQIGEU-DSSLUBNTSA-N
Formula
C42H48F3N5O10S2
Mass
903.99
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
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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
Macrolactams Alpha amino acid amides Phenylpyridines Isoquinolines and derivatives Anisoles Phenoxy compounds Alkyl aryl ethers Cyclopropanecarboxylic acids and derivatives Tertiary carboxylic acid amides Aminosulfonyl compounds Carbamate esters Pyrrolidines Heteroaromatic compounds Organosulfonic acids and derivatives Secondary carboxylic acid amides Trihalomethanes Lactams Dialkylthioethers Azacyclic compounds Alkyl fluorides Carbonyl compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cyclic alpha peptide - Macrolactam - Alpha-amino acid amide - 2-phenylpyridine - Alpha-amino acid or derivatives - Isoquinoline - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Cyclopropanecarboxylic acid or derivatives - Pyridine - Benzenoid - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Carbamic acid ester - Heteroaromatic compound - Secondary carboxylic acid amide - Trihalomethane - Carboxamide group - Lactam - Dialkylthioether - Thioether - Organoheterocyclic compound - Azacycle - Ether - Hydrocarbon derivative - Organic oxide - Alkyl fluoride - Halomethane - Alkyl halide - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organooxygen compound - Organohalogen compound - Organofluoride - Organonitrogen 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