Compound Identification
SMILES
CCOC(CNC(=O)C[C@@H](CC1=COC2=CC=CC=C12)C(=O)N[C@@H](CC1=CN=CN1)C(=O)N[C@H](CC1CCCCC1)[C@H](O)C1=CC=CO1)OCC
InChIKey
InChIKey=LXUBHLISYZBLKS-AXMUHIPKSA-N
Formula
C38H51N5O8
Mass
705.853
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Carboxylic acids and derivatives
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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
N-acyl-alpha amino acids and derivatives Alpha amino acid amides Benzofurans N-acyl amines Benzenoids Imidazoles Heteroaromatic compounds Furans Secondary carboxylic acid amides Secondary alcohols Oxacyclic compounds Acetals Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Aromatic alcohols Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Histidine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Benzofuran - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Azole - Furan - Heteroaromatic compound - Imidazole - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Oxacycle - Acetal - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Aromatic alcohol - Aromatic heteropolycyclic 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