Compound Identification
SMILES
COC1=C(O)C=CC(\C=C\C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(O)=O)=C1
InChIKey
InChIKey=CZTRBMMRFGMOKC-XXJKJQDVSA-N
Formula
C18H20N2O6S
Mass
392.43
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
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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 N-acyl-alpha amino acids and derivatives Cinnamic acid amides Hydroxycinnamic acids and derivatives Methoxyphenols Phenoxy compounds Styrenes Anisoles Methoxybenzenes Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Tertiary carboxylic acid amides Thiazolidines Secondary carboxylic acid amides Azetidines Monocarboxylic acids and derivatives Azacyclic compounds Dialkylthioethers Thiohemiaminal derivatives Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-dipeptide - Penicillin - N-acyl-alpha amino acid or derivatives - Cinnamic acid amide - Cinnamic acid or derivatives - Hydroxycinnamic acid or derivatives - Methoxyphenol - Alpha-amino acid or derivatives - Methoxybenzene - Anisole - Penam - Phenoxy compound - Phenol ether - Styrene - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Monocyclic benzene moiety - Benzenoid - Beta-lactam - Thiazolidine - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Azetidine - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Dialkylthioether - Carboxylic acid - Hemithioaminal - Thioether - Ether - Monocarboxylic acid or derivatives - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - 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