Structure Information
Structure

Compound Identification

SMILES

[SH3+].COS(O)(=O)=O.COC1=CC(=CC(OC)=C1OC)C(=O)CN[C@@H](CCSC)C([O-])=O

InChIKey

InChIKey=ADTGPYBQXQAUCK-IDMXKUIJSA-N

Formula

C17H29NO10S3

Mass

503.6

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Methionine and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Methionine or derivatives - Alkyl-phenylketone - Alpha-amino acid - L-alpha-amino acid - Phenylketone - Phenoxy compound - Anisole - Benzoyl - Phenol ether - Methoxybenzene - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - Thia fatty acid - Monocyclic benzene moiety - Sulfuric acid monoester - Sulfate-ester - Fatty acyl - Alkyl sulfate - Sulfuric acid ester - Benzenoid - Alpha-aminoketone - Organic sulfuric acid or derivatives - Amino acid - Carboxylic acid salt - Ketone - Dialkylthioether - Sulfenyl compound - Thioether - Carboxylic acid - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Secondary amine - Organic zwitterion - Amine - Carbonyl group - Organic oxide - Organic oxygen compound - Organic salt - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as methionine and derivatives. These are compounds containing methionine or a derivative thereof resulting from reaction of methionine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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