Compound Identification
SMILES
CCOC(=O)[C@H](C)NP(=O)(OC[C@]1(O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1N=CN=C2N)N=[N+]=[N-])OC1=CC=CC2=CC=CC=C12
InChIKey
InChIKey=KJBIJOQBPBUBKI-GHQXTCINSA-N
Formula
C25H28N9O8P
Mass
613.528
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
-
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
Glycosylamines Alanine and derivatives Pentoses 6-aminopurines Naphthalenes Phosphoric diester monoamides Aminopyrimidines and derivatives Imidolactams N-substituted imidazoles Organic phosphoramides Heteroaromatic compounds Oxolanes Azo imides 1,2-diols Carboxylic acid esters Secondary alcohols Azo compounds Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Primary amines Organic salts Organic zwitterions Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid ester - Alanine or derivatives - N-glycosyl compound - Glycosyl compound - 6-aminopurine - Pentose monosaccharide - Naphthalene - Purine - Imidazopyrimidine - Phosphoric diester monoamide - Aminopyrimidine - Imidolactam - Organic phosphoric acid amide - Benzenoid - Monosaccharide - N-substituted imidazole - Pyrimidine - Organic phosphoric acid derivative - Phosphoric acid ester - Oxolane - Azole - Imidazole - Heteroaromatic compound - 1,2-diol - Azo compound - Azo imide - Carboxylic acid ester - Secondary alcohol - Monocarboxylic acid or derivatives - Oxacycle - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organic salt - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Alcohol - Organic nitrogen compound - Organic oxide - Organic zwitterion - Amine - Primary amine - Organooxygen 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