Compound Identification
SMILES
CC(C)[C@H](NC1=CC=CC=C1C(=O)NCCCCN1CCN(CC1)C1=NSC2=CC=CC=C12)C(O)=O
InChIKey
InChIKey=GSZHOWDOPPWVOO-DEOSSOPVSA-N
Formula
C27H35N5O3S
Mass
509.67
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 Valine 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
Valine and derivatives
Alternative Parents
N-arylpiperazines Anthranilamides 2-aminobenzamides L-alpha-amino acids Benzothiazoles Aniline and substituted anilines Phenylalkylamines Benzoyl derivatives Dialkylarylamines Secondary alkylarylamines N-alkylpiperazines Aminothiazoles Imidolactams Vinylogous amides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids Carboxylic acids Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Valine or derivatives - N-arylpiperazine - Alpha-amino acid - Anthranilamide - Aminobenzamide - Aminobenzoic acid or derivatives - L-alpha-amino acid - 2-aminobenzamide - Benzamide - Benzoic acid or derivatives - 1,2-benzothiazole - Benzoyl - Dialkylarylamine - Aniline or substituted anilines - Phenylalkylamine - N-alkylpiperazine - Secondary aliphatic/aromatic amine - Imidolactam - Benzenoid - 1,2-thiazolamine - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Vinylogous amide - Azole - Thiazole - Heteroaromatic compound - Tertiary aliphatic amine - Amino acid - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid - Secondary amine - Monocarboxylic acid or derivatives - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available