Compound Identification
SMILES
ClC1=CC=C(S1)C=CS(=O)(=O)N[C@H]1CCCN(CC(=O)N2CCC[C@H]2CN2CCN(CC2)C(=O)C2=CC=CS2)C1=O
InChIKey
InChIKey=HOFLGVCIRHPGSQ-UNMCSNQZSA-N
Formula
C27H34ClN5O5S3
Mass
640.23
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
-
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
Thiophene carboxamides 2-heteroaryl carboxamides N-acylpyrrolidines Piperidinones 2,5-disubstituted thiophenes N-alkylpiperazines Delta lactams Organosulfonamides Organic sulfonamides Aryl chlorides Tertiary carboxylic acid amides Aminosulfonyl compounds Heteroaromatic compounds Trialkylamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid or derivatives - 2-heteroaryl carboxamide - N-acylpyrrolidine - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Delta-lactam - Piperidinone - N-alkylpiperazine - 2,5-disubstituted thiophene - Aryl chloride - Aryl halide - 1,4-diazinane - Piperazine - Piperidine - Organic sulfonic acid amide - Organosulfonic acid amide - Aminosulfonyl compound - Thiophene - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrolidine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Tertiary amine - Carboxamide group - Tertiary aliphatic amine - Lactam - Organoheterocyclic compound - Azacycle - Amine - Organohalogen compound - Organic oxide - Organochloride - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic 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