Compound Identification
SMILES
O[N+]([O-])=O.CC(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H](CCCN=C(N)[NH3+])C(=O)C1=NC2=CC=CC=C2S1
InChIKey
InChIKey=IIHJVIGCQMJFSL-WEMUQIOZSA-O
Formula
C20H28N7O7S
Mass
510.55
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
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Level 5
Amino acids and derivatives
-
Level 6
Alpha amino acids and derivatives
- Level 7 Proline and derivatives
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Level 6
Alpha amino acids and derivatives
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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
Proline and derivatives
Alternative Parents
Alpha amino acid amides Benzothiazoles N-acylpyrrolidines Aryl alkyl ketones Pyrrolidinecarboxamides Benzenoids Thiazoles Tertiary carboxylic acid amides Heteroaromatic compounds Organic nitrates Quaternary ammonium salts Acetamides Secondary carboxylic acid amides Secondary alcohols Guanidines Organic nitric acids Organic nitro compounds Carboximidamides Azacyclic compounds Organic salts Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Proline or derivatives - Alpha-amino acid amide - 1,3-benzothiazole - Aryl ketone - Aryl alkyl ketone - Pyrrolidine-2-carboxamide - Pyrrolidine carboxylic acid or derivatives - N-acylpyrrolidine - Benzenoid - Acetamide - Quaternary ammonium salt - Pyrrolidine - Tertiary carboxylic acid amide - Organic nitrate - Heteroaromatic compound - Thiazole - Azole - Carboxamide group - Guanidine - Ketone - Organic nitric acid - Organic nitric acid or derivatives - Organic nitro compound - Secondary alcohol - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboximidamide - Organonitrogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Organic salt - Alcohol - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as proline and derivatives. These are compounds containing proline or a derivative thereof resulting from reaction of proline at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available