Compound Identification
SMILES
COC(=O)[C@@]1(CC2=CC=C(OC)C=C2)[C@@H]2[C@H](CN1C(=O)C1=CC=CC=C1)CC1=C2C=C(N1CCC1=CNC2=C1C=C(O)C=C2)C(=O)N1CCCC1
InChIKey
InChIKey=KBGODNRRRTZUEZ-JZIVADLGSA-N
Formula
C41H42N4O6
Mass
686.809
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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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
N-acyl-alpha amino acids and derivatives
- Level 8 N-acyl-alpha amino acids
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Level 7
N-acyl-alpha amino acids 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 - N-acyl-alpha amino acids and derivatives
Direct Parent
N-acyl-alpha amino acids
Alternative Parents
Alpha amino acid esters Amphetamines and derivatives 3-alkylindoles Hydroxyindoles Benzamides Anisoles Pyrrolidine carboxylic acids Benzoyl derivatives Pyrrole carboxamides Phenoxy compounds Methoxybenzenes N-acylpyrrolidines 2-heteroaryl carboxamides Alkyl aryl ethers Fatty acid esters 1-hydroxy-2-unsubstituted benzenoids Substituted pyrroles Heteroaromatic compounds Tertiary carboxylic acid amides Methyl esters Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha-amino acid - Alpha-amino acid ester - 3-alkylindole - Amphetamine or derivatives - Hydroxyindole - Benzoic acid or derivatives - Indole or derivatives - Benzamide - Indole - Benzoyl - 2-heteroaryl carboxamide - Phenol ether - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - N-acylpyrrolidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Anisole - Methoxybenzene - Phenoxy compound - Fatty acid ester - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Substituted pyrrole - Pyrrole - Pyrrolidine - Tertiary carboxylic acid amide - Methyl ester - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Organoheterocyclic compound - Azacycle - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available