Compound Identification
SMILES
CCCC[C@@H](NC(=O)C(CC(C)C)NC(=O)COC1=CC=C(OC)C=C1)C(=O)CSCC1=CC=CO1
InChIKey
InChIKey=VXUIEVMTNZYZCW-MIHMCVIASA-N
Formula
C27H38N2O6S
Mass
518.67
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 Leucine 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
Leucine and derivatives
Alternative Parents
N-acyl-alpha amino acids and derivatives Alpha amino acid amides Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers N-acyl amines Furans Heteroaromatic compounds Ketones Secondary carboxylic acid amides Sulfenyl compounds Dialkylthioethers Oxacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Leucine or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Anisole - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Benzenoid - N-acyl-amine - Heteroaromatic compound - Furan - Carboxamide group - Ketone - Secondary carboxylic acid amide - Oxacycle - Organoheterocyclic compound - Ether - Dialkylthioether - Sulfenyl compound - Thioether - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Carbonyl group - Organosulfur compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as leucine and derivatives. These are compounds containing leucine or a derivative thereof resulting from reaction of leucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
External Descriptors
Not available