Compound Identification
SMILES
COCC1=C(N2[C@@H](SC1)[C@@H](NC(=O)C(NC(=O)OC(C)(C)C)C1=CC=CC=C1)C2=O)C(O)=O
InChIKey
InChIKey=XWYUUHCLCCZDBJ-KDBUZZBASA-N
Formula
C22H27N3O7S
Mass
477.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
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
-
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
Not available
Direct Parent
Peptides
Alternative Parents
Cephalosporins N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenylacetamides 1,3-thiazines Tertiary carboxylic acid amides Carbamate esters Secondary carboxylic acid amides Azetidines Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Dialkylthioethers Dialkyl ethers Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha peptide - Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Phenylacetamide - Cephem - Meta-thiazine - Monocyclic benzene moiety - Benzenoid - Beta-lactam - Carbamic acid ester - Tertiary carboxylic acid amide - Azetidine - Carboxamide group - Lactam - Secondary carboxylic acid amide - Hemithioaminal - Monocarboxylic acid or derivatives - Thioether - Ether - Dialkyl ether - Dialkylthioether - Organoheterocyclic compound - Carboxylic acid - Azacycle - Organic oxide - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen 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