Compound Identification
SMILES
CNC(=O)[C@@H]1CCCN1S(=O)(=O)CCNS(=O)(=O)C[C@H](C)NC(=O)OC(C)(C)C
InChIKey
InChIKey=KQKYOCAIKNWNKB-STQMWFEESA-N
Formula
C16H32N4O7S2
Mass
456.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Peptidomimetics
- Subclass Beta-sulfonopeptides
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Class
Peptidomimetics
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Peptidomimetics
Subclass
Beta-sulfonopeptides
Intermediate Tree Nodes
Not available
Direct Parent
Beta-sulfonopeptides
Alternative Parents
Proline and derivatives Alpha amino acid amides Pyrrolidinecarboxamides Organosulfonamides Organic sulfonamides Carbamate esters Aminosulfonyl compounds Secondary carboxylic acid amides Organic carbonic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Beta-sulfonopeptide fragment - Proline or derivatives - Alpha-amino acid amide - Alpha-amino acid or derivatives - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - Organosulfonic acid amide - Organic sulfonic acid amide - Aminosulfonyl compound - Carbamic acid ester - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Secondary carboxylic acid amide - Carbonic acid derivative - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as beta-sulfonopeptides. These are peptide analogues containing two 2-sulfonylethan-1-amine groups linked together through a bond between the terminal nitrogen atom of one group and the sulfur atom (of the sulfonyl ) from the other group.
External Descriptors
Not available