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(N1CC1=CC=CC2=CC=CC=C12)C(=O)N(C)C
InChIKey
InChIKey=MOILRQCOJTVQJR-JVUNTEAGSA-N
Formula
C40H39N3O5
Mass
641.768
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
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
-
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 Naphthalenes Benzamides 2-heteroaryl carboxamides Anisoles Pyrrolidine carboxylic acids Benzoyl derivatives Methoxybenzenes N-acylpyrrolidines Pyrrole carboxamides Phenoxy compounds Fatty acid esters Alkyl aryl ethers Substituted pyrroles Heteroaromatic compounds Methyl esters Tertiary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha-amino acid - Alpha-amino acid ester - Naphthalene - Amphetamine or derivatives - Benzamide - Benzoic acid or derivatives - Pyrrolidine carboxylic acid or derivatives - Anisole - Phenol ether - Methoxybenzene - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Benzoyl - 2-heteroaryl carboxamide - N-acylpyrrolidine - Pyrrolidine carboxylic acid - Phenoxy compound - Alkyl aryl ether - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - 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