Compound Identification
SMILES
OC(=O)C1=C(C=CC(SCC2=C(N3C(SC2)C(NC(=O)CNC(=O)C2=CC4=CC(Cl)=C(O)C=C4OC2=O)C3=O)C(O)=O)=C1)C1=C2C=CC(=O)C=C2OC2=C1C=CC(O)=C2
InChIKey
InChIKey=PPKNYFHOGOVCAM-UHFFFAOYSA-N
Formula
C40H26ClN3O13S2
Mass
856.23
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
- 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
Not available
Direct Parent
Peptides
Alternative Parents
Cephalosporins Xanthenes N-acyl-alpha amino acids and derivatives 7-hydroxycoumarins Alpha amino acid amides M-sulfanylbenzoic acids Benzoic acids Thiophenol ethers Benzoyl derivatives Halophenols 1-hydroxy-2-unsubstituted benzenoids Pyranones and derivatives Alkylarylthioethers 1,3-thiazines Aryl chlorides Heteroaromatic compounds Tertiary carboxylic acid amides Cyclic ketones Secondary carboxylic acid amides Lactones Azetidines Thiohemiaminal derivatives Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Organochlorides Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha peptide - Cephalosporin - Xanthene - Dibenzopyran - N-acyl-alpha amino acid or derivatives - 7-hydroxycoumarin - Alpha-amino acid amide - Hydroxycoumarin - Coumarin - Alpha-amino acid or derivatives - Benzopyran - M-sulfanylbenzoic acid or derivatives - M-sulfanylbenzoic acid - 1-benzopyran - N-substituted-alpha-amino acid - Benzoic acid - Benzoic acid or derivatives - Cephem - Aryl thioether - Thiophenol ether - 2-halophenol - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Alkylarylthioether - Phenol - Pyranone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyran - Benzenoid - Meta-thiazine - Tertiary carboxylic acid amide - Beta-lactam - Heteroaromatic compound - Azetidine - Secondary carboxylic acid amide - Lactone - Lactam - Cyclic ketone - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid - Dialkylthioether - Oxacycle - Sulfenyl compound - Hemithioaminal - Monocarboxylic acid or derivatives - Thioether - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as peptides. These are compounds containing an amide derived from two or more amino carboxylic acid molecules (the same or different) by formation of a covalent bond from the carbonyl carbon of one to the nitrogen atom of another.
External Descriptors
Not available