Compound Identification
SMILES
C[N+](C)(C)C(CCC1=NC(CC(N)C([O-])=O)=CN1[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O)C(N)=O
InChIKey
InChIKey=ZBHYRBYADYEBBR-RVLLNOQMSA-N
Formula
C18H31N5O7
Mass
429.474
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
-
Level 6
Alpha amino acids and derivatives
- Level 7 Histidine and derivatives
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Level 6
Alpha amino acids and derivatives
-
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
Imidazole ribonucleosides and ribonucleotides Alpha amino acid amides Glycosylamines Pentoses Alpha amino acids 1,2,4-trisubstituted imidazoles Imidazolyl carboxylic acids and derivatives Aralkylamines Fatty amides N-substituted imidazoles Tetraalkylammonium salts Heteroaromatic compounds Oxolanes Primary carboxylic acid amides Carboxylic acid salts Secondary alcohols Amino acids 1,2-diols Oxacyclic compounds Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Monoalkylamines Organic oxides Organic salts Organic zwitterions Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Histidine or derivatives - Imidazole ribonucleoside - Alpha-amino acid amide - N-glycosyl compound - Glycosyl compound - Pentose monosaccharide - Alpha-amino acid - 1,2,4-trisubstituted-imidazole - Imidazolyl carboxylic acid derivative - Trisubstituted imidazole - Aralkylamine - Monosaccharide - N-substituted imidazole - Fatty amide - Fatty acyl - Azole - Quaternary ammonium salt - Heteroaromatic compound - Tetraalkylammonium salt - Oxolane - Imidazole - Secondary alcohol - Primary carboxylic acid amide - Amino acid - Carboxamide group - 1,2-diol - Carboxylic acid salt - Oxacycle - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Primary amine - Organic zwitterion - Organic salt - Organic oxide - Alcohol - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Amine - Primary alcohol - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - 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