Compound Identification
SMILES
COC(=O)C(C)NP(=O)(OC[C@H]1O[C@H](C=C1)N1C=C(C)C(=O)NC1=O)OC1=CC=C(Br)C=C1
InChIKey
InChIKey=VPABMVYNSQRPBD-RNOBUQKWSA-N
Formula
C20H23BrN3O8P
Mass
544.295
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
Nucleoside and nucleotide analogues Alanine and derivatives Phosphoric diester monoamides Phenoxy compounds Pyrimidones Bromobenzenes Aryl bromides Hydropyrimidines Organic phosphoramides Vinylogous amides Dihydrofurans Heteroaromatic compounds Methyl esters Lactams Ureas Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organonitrogen compounds Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - Alanine or derivatives - Phenoxy compound - Phosphoric diester monoamide - Bromobenzene - Halobenzene - Pyrimidone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Hydropyrimidine - Organic phosphoric acid derivative - Phosphoric acid ester - Pyrimidine - Benzenoid - Organic phosphoric acid amide - Heteroaromatic compound - Vinylogous amide - Dihydrofuran - Methyl ester - Urea - Carboxylic acid ester - Lactam - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Organoheterocyclic compound - Organic nitrogen compound - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organobromide - Organonitrogen compound - Organooxygen 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