Compound Identification
SMILES
CC(=O)OCC1=C(N2C(SC1)C(NC(=O)C(NC(=O)NC(=O)C1=CC=CO1)C1=CC=CC=C1)C2=O)C(O)=O
InChIKey
InChIKey=HSCYOROICHVXLC-UHFFFAOYSA-N
Formula
C24H22N4O9S
Mass
542.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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
Cephalosporin 3'-esters N-carbamoyl-alpha amino acids and derivatives N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenylacetamides Furoic acid and derivatives Dicarboxylic acids and derivatives 1,3-thiazines Tertiary carboxylic acid amides Heteroaromatic compounds Ureas Secondary carboxylic acid amides Carboxylic acid esters Azetidines Thiohemiaminal derivatives Oxacyclic compounds Dialkylthioethers Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin 3'-ester - Alpha peptide - Cephalosporin - N-carbamoyl-alpha-amino acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Phenylacetamide - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - Cephem - Furoic acid or derivatives - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Meta-thiazine - Heteroaromatic compound - Tertiary carboxylic acid amide - Furan - Beta-lactam - Urea - Secondary carboxylic acid amide - Carbonic acid derivative - Lactam - Carboxylic acid ester - Carboxamide group - Azetidine - Oxacycle - Azacycle - Organoheterocyclic compound - Dialkylthioether - Hemithioaminal - Thioether - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Carbonyl group - 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