Compound Identification
SMILES
COC1=CC(NC(=O)C[C@H](N2CCNCC2)C(O)=O)=C(OC)C=C1
InChIKey
InChIKey=GYMKSHHXCXWRGX-ZDUSSCGKSA-N
Formula
C16H23N3O5
Mass
337.376
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
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Level 6
Alpha amino acids and derivatives
- Level 7 Asparagine and derivatives
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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
Asparagine and derivatives
Alternative Parents
Dimethoxybenzenes L-alpha-amino acids Anilides Methoxyanilines Anisoles Phenoxy compounds N-arylamides Alkyl aryl ethers N-alkylpiperazines Fatty amides Amino acids Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Dialkylamines Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Asparagine or derivatives - Alpha-amino acid - L-alpha-amino acid - P-dimethoxybenzene - Dimethoxybenzene - Methoxyaniline - Anilide - Phenoxy compound - Anisole - Phenol ether - N-arylamide - Methoxybenzene - Alkyl aryl ether - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Fatty amide - Piperazine - Benzenoid - Fatty acyl - Tertiary amine - Secondary carboxylic acid amide - Amino acid - Tertiary aliphatic amine - Carboxamide group - Secondary amine - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Amine - Carbonyl group - Organonitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available