Compound Identification
SMILES
COC1=CC=C(CN[C@H]([C@H](O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)CCC2=CC=CC=C2O)C(C)(C)C)C(=O)NC2[C@H](O)CC3=CC=CC=C23)C=C1
InChIKey
InChIKey=YMNDBCNMYBNUHW-IHDKLEJVSA-N
Formula
C43H52N4O7
Mass
736.91
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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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
N-acyl-alpha amino acids and derivatives
Alternative Parents
Valine and derivatives Alpha amino acid amides Phenylbutylamines Amphetamines and derivatives Indanes Anisoles Benzylamines Phenylmethylamines Methoxybenzenes Phenoxy compounds 1-hydroxy-4-unsubstituted benzenoids Aralkylamines 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers N-acyl amines Secondary carboxylic acid amides Secondary alcohols Dialkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Valine or derivatives - Alpha-amino acid amide - Phenylbutylamine - Amphetamine or derivatives - Indane - Phenoxy compound - Anisole - Methoxybenzene - Benzylamine - Phenol ether - Phenylmethylamine - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Alkyl aryl ether - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Monocyclic benzene moiety - Fatty acyl - Fatty amide - Benzenoid - N-acyl-amine - Carboxamide group - Secondary carboxylic acid amide - Secondary alcohol - Ether - Secondary aliphatic amine - Secondary amine - Organic oxide - Amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available