Compound Identification
SMILES
C[C@@H]1CC[C@H](NC(=O)[C@H](CC2CCCC2)NC(=O)C2=CC=C(O2)C2=CC=C(Cl)C=C2)C(=O)CN1S(=O)(=O)C1=CC=CC=N1
InChIKey
InChIKey=OQOCONWVNLRGOF-YNJKOYDBSA-N
Formula
C31H35ClN4O6S
Mass
627.15
Taxonomic Classification
Taxonomy Tree
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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
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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 - Alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids and derivatives
Alternative Parents
Alpha amino acid amides Pyridinesulfonamides 2-heteroaryl carboxamides Furoic acid and derivatives Azepanes Chlorobenzenes Aryl chlorides Organosulfonamides Fatty amides Sulfonyls Heteroaromatic compounds Cyclic ketones Secondary carboxylic acid amides Azacyclic compounds Oxacyclic compounds Organic oxides Organochlorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Pyridine-2-sulfonamide - 2-heteroaryl carboxamide - Furoic acid or derivatives - Azepane - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Pyridine - Organosulfonic acid amide - Benzenoid - Fatty acyl - Organic sulfonic acid or derivatives - Sulfonyl - Organosulfonic acid or derivatives - Heteroaromatic compound - Furan - Secondary carboxylic acid amide - Carboxamide group - Cyclic ketone - Ketone - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organic nitrogen compound - Organochloride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available