Compound Identification
SMILES
CC1=CC(C)=C(SCC(N2C(=O)N3CC=CC(N3C2=O)C(=O)NCC2CCC(N)CC2)C(O)=O)C=C1
InChIKey
InChIKey=JYXFAJQHHKDGDB-UHFFFAOYSA-N
Formula
C25H33N5O5S
Mass
515.63
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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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
Direct Parent
Alpha amino acids and derivatives
Alternative Parents
Triazolopyridazines m-Xylenes Thiophenol ethers Urazoles Alkylarylthioethers Cyclohexylamines Pyridazines and derivatives Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids Sulfenyl compounds Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Triazolopyridazine - Aryl thioether - M-xylene - Xylene - Thiophenol ether - Cyclohexylamine - Urazole - Alkylarylthioether - Monocyclic benzene moiety - Pyridazine - Benzenoid - Azole - 1,2,4-triazole - Heteroaromatic compound - Carboxamide group - Amino acid - Secondary carboxylic acid amide - Organoheterocyclic compound - Sulfenyl compound - Azacycle - Carboxylic acid - Monocarboxylic acid or derivatives - Thioether - Organonitrogen compound - Organic oxygen compound - Primary aliphatic amine - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Primary amine - Hydrocarbon derivative - Amine - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
External Descriptors
Not available