Compound Identification
SMILES
COC(=O)[C@H](CC1=CN=CN1)NC(=O)CC1=CC=C(C=C1)N(CCCl)CCCl
InChIKey
InChIKey=OKSCSVIOPIVWTC-KRWDZBQOSA-N
Formula
C19H24Cl2N4O3
Mass
427.33
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
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 Histidine 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
Histidine and derivatives
Alternative Parents
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Phenylacetamides Aniline and substituted anilines Dialkylarylamines Imidazolyl carboxylic acids and derivatives Nitrogen mustard compounds Fatty acid esters Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Alkyl chlorides Hydrocarbon derivatives Carbonyl compounds Organopnictogen compounds Organic oxides Organochlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Histidine or derivatives - Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Phenylacetamide - Tertiary aliphatic/aromatic amine - Nitrogen mustard - Dialkylarylamine - Aniline or substituted anilines - Imidazolyl carboxylic acid derivative - Fatty acid ester - Fatty acyl - Monocyclic benzene moiety - Benzenoid - Azole - Methyl ester - Heteroaromatic compound - Imidazole - Carboxamide group - Carboxylic acid ester - Tertiary amine - Secondary carboxylic acid amide - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Amine - Organic nitrogen compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl chloride - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as histidine and derivatives. These are compounds containing cysteine or a derivative thereof resulting from reaction of cysteine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available