Compound Identification
SMILES
[Na+].CC1(C)S[C@H]2[C@@H](NC(=O)[C@H](NC(=O)C3=CNC4=C(N=CC=C4)C3=O)C3=CC=CC=C3)C(=O)N2[C@@H]1C([O-])=O
InChIKey
InChIKey=DIGBQDMXLUJMHN-DCTMXOOQSA-M
Formula
C25H22N5NaO6S
Mass
543.53
Taxonomic Classification
Taxonomy Tree
-
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
Penicillins N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenylacetamides Naphthyridines Pyridinecarboxylic acids and derivatives Vinylogous amides Thiazolidines Tertiary carboxylic acid amides Heteroaromatic compounds Secondary carboxylic acid amides Azetidines Carboxylic acid salts Thiohemiaminal derivatives Azacyclic compounds Carboxylic acids Dialkylthioethers Monocarboxylic acids and derivatives Organonitrogen compounds Carbonyl compounds Organic sodium salts Hydrocarbon derivatives Organic zwitterions Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha peptide - Penicillin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Diazanaphthalene - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Phenylacetamide - Naphthyridine - Pyridine carboxylic acid or derivatives - Penam - Monocyclic benzene moiety - Pyridine - Benzenoid - Heteroaromatic compound - Beta-lactam - Tertiary carboxylic acid amide - Thiazolidine - Vinylogous amide - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid salt - Azetidine - Lactam - Azacycle - Organic alkali metal salt - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Dialkylthioether - Hemithioaminal - Thioether - Organic oxide - Organic sodium salt - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Organonitrogen compound - Organooxygen compound - Organic oxygen 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