Compound Identification
SMILES
COC1=CC(C(N2CCCCC2C(O)=O)C2=NC3=CC=CC=C3S2)=C(OC)C=C1
InChIKey
InChIKey=ZLANBIITQJMKOD-UHFFFAOYSA-N
Formula
C22H24N2O4S
Mass
412.5
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 Alpha amino acids
-
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
Alpha amino acids
Alternative Parents
Dimethoxybenzenes Piperidinecarboxylic acids Benzothiazoles Phenoxy compounds Anisoles Alkyl aryl ethers Aralkylamines Thiazoles Heteroaromatic compounds Trialkylamines Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dimethoxybenzene - Alpha-amino acid - P-dimethoxybenzene - Piperidinecarboxylic acid - 1,3-benzothiazole - Phenol ether - Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Piperidine - Benzenoid - Monocyclic benzene moiety - Thiazole - Azole - Heteroaromatic compound - Amino acid - Tertiary aliphatic amine - Tertiary amine - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Azacycle - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
External Descriptors
Not available