Compound Identification
SMILES
CC(N\C=C1\CC(C)N(C)C(C)CC1=O)C(O)=O
InChIKey
InChIKey=MIVJJKDCSPINOJ-XFFZJAGNSA-N
Formula
C13H22N2O3
Mass
254.33
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 Alanine and derivatives
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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
Alanine and derivatives
Alternative Parents
Alpha amino acids Azepanes Vinylogous amides Trialkylamines Cyclic ketones Amino acids Monocarboxylic acids and derivatives Enamines Dialkylamines Carboxylic acids Azacyclic compounds Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Alanine or derivatives - Alpha-amino acid - Azepane - Vinylogous amide - Ketone - Tertiary amine - Amino acid - Tertiary aliphatic amine - Cyclic ketone - Carboxylic acid - Secondary aliphatic amine - Enamine - Monocarboxylic acid or derivatives - Secondary amine - Allylamine - Azacycle - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Amine - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as alanine and derivatives. These are compounds containing alanine or a derivative thereof resulting from reaction of alanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available