Compound Identification
SMILES
CCCSC1=C(N=C(N)S1)C1=CC=C(O1)P(=O)(NC(C)C(=O)OC(C)C)NC(C)C(=O)OC(C)C
InChIKey
InChIKey=ATNUXEDDQLJHSY-UHFFFAOYSA-N
Formula
C22H35N4O6PS2
Mass
546.64
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
-
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
Alanine and derivatives 2,4,5-trisubstituted thiazoles Alkylarylthioethers 2-amino-1,3-thiazoles Dicarboxylic acids and derivatives Organic phosphonic acids and derivatives Furans Heteroaromatic compounds Carboxylic acid esters Sulfenyl compounds Azacyclic compounds Oxacyclic compounds Primary amines Carbonyl compounds Organophosphorus compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Alanine or derivatives - 2,4,5-trisubstituted 1,3-thiazole - Aryl thioether - Alkylarylthioether - Dicarboxylic acid or derivatives - 1,3-thiazol-2-amine - Azole - Furan - Organophosphonic acid derivative - Thiazole - Heteroaromatic compound - Carboxylic acid ester - Sulfenyl compound - Thioether - Oxacycle - Azacycle - Organoheterocyclic compound - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Organic oxygen compound - Organic oxide - Organophosphorus compound - Carbonyl group - Hydrocarbon derivative - Organosulfur compound - Organic nitrogen compound - Aromatic heteromonocyclic 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