Compound Identification
SMILES
CCOC1=CC=C2C=CC(N)CC2=C1C(=O)NC1C2SC(C)(C)C(N2C1=O)C(O)=O
InChIKey
InChIKey=RFKFVZQROURZCF-UHFFFAOYSA-N
Formula
C21H25N3O5S
Mass
431.51
Taxonomic Classification
Taxonomy Tree
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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
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Level 5
Peptides
- Level 6 Dipeptides
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Level 5
Peptides
-
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
Peptides
Direct Parent
Dipeptides
Alternative Parents
Penicillins Naphthalenecarboxylic acids and derivatives N-acyl-alpha amino acids and derivatives Alkyl aryl ethers Aralkylamines Thiazolidines Tertiary carboxylic acid amides Secondary carboxylic acid amides Amino acids Azetidines Thiohemiaminal derivatives Azacyclic compounds Monocarboxylic acids and derivatives Carboxylic acids Dialkylthioethers Carbonyl compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Penicillin - N-acyl-alpha amino acid or derivatives - 1-naphthalenecarboxylic acid or derivatives - Alpha-amino acid or derivatives - Naphthalene - Penam - Alkyl aryl ether - Aralkylamine - Benzenoid - Tertiary carboxylic acid amide - Beta-lactam - Thiazolidine - Lactam - Carboxamide group - Amino acid - Secondary carboxylic acid amide - Azetidine - Amino acid or derivatives - Azacycle - Carboxylic acid - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Dialkylthioether - Hemithioaminal - Thioether - Organopnictogen compound - Amine - Organic oxygen compound - Organic nitrogen compound - Primary aliphatic amine - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dipeptides. These are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond.
External Descriptors
Not available