Compound Identification
SMILES
COC(=O)[C@@H]1CSC2=C3C(=O)OC4=C5C(=CC(O)=C4O)C(=O)OC(C4=C2N1C(C)=C4)=C35
InChIKey
InChIKey=ZYFOPLJPIMJKQW-VIFPVBQESA-N
Formula
C21H13NO8S
Mass
439.39
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
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Alpha amino acid esters
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Level 6
Alpha amino acids and derivatives
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Level 5
Amino acids and derivatives
-
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
Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent
Alpha amino acid esters
Alternative Parents
7,8-dihydroxycoumarins Isocoumarins and derivatives 1-benzopyrans 2-benzopyrans Benzothiazines Indoles 1-hydroxy-2-unsubstituted benzenoids Pyranones and derivatives Alkylarylthioethers 1,4-thiazines Vinylogous thioesters Substituted pyrroles Heteroaromatic compounds Methyl esters Lactones Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
7,8-dihydroxycoumarin - Alpha-amino acid ester - Coumarin - Isocoumarin - Benzopyran - Benzothiazine - 1-benzopyran - 2-benzopyran - Indole - Indole or derivatives - Aryl thioether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Alkylarylthioether - Pyranone - Para-thiazine - Vinylogous thioester - Benzenoid - Pyran - Substituted pyrrole - Methyl ester - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Lactone - Thioether - Organoheterocyclic compound - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.
External Descriptors
Not available