Compound Identification
SMILES
CC1=C(C)C(NC(=O)C[C@H]([NH2+]C[C@@H]2CCCO2)C([O-])=O)=CC=C1
InChIKey
InChIKey=NUZPWCCIYOWCOD-ZFWWWQNUSA-N
Formula
C17H24N2O4
Mass
320.389
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
-
Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Asparagine and derivatives
-
Level 6
Alpha amino acids and derivatives
-
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
L-alpha-amino acids Anilides o-Xylenes N-arylamides Fatty amides Oxolanes Secondary carboxylic acid amides Amino acids Carboxylic acid salts Oxacyclic compounds Carboxylic acids Dialkyl ethers Dialkylamines Monocarboxylic acids and derivatives Carbonyl compounds Organic zwitterions Organic salts Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Asparagine or derivatives - Alpha-amino acid - L-alpha-amino acid - Anilide - O-xylene - Xylene - N-arylamide - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - Oxolane - Carboxamide group - Carboxylic acid salt - Amino acid - Secondary carboxylic acid amide - Carboxylic acid - Dialkyl ether - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Oxacycle - Secondary amine - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxide - Organic nitrogen compound - Organic salt - Organic zwitterion - 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