Structure Information
Structure

Compound Identification

SMILES

[Zr+4].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.COC(=O)[C@@H](NC(=O)[C@@H]([N-]C(C)=O)C(C)C)C(C)C.C1=CC=C(C=C1)[B-](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=UBDBMBUOWQHQPS-UXDXUJKSSA-M

Formula

C47H53BN2O4Zr

Mass

811.98

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Not available

Substituents

Alpha-amino acid ester - Valine or derivatives - N-acyl-alpha amino acid or derivatives - Fatty acid ester - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Fatty acyl - Benzenoid - Methyl ester - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Cyclic olefin - Cycloalkene - Monocarboxylic acid or derivatives - Organic metalloid salt - Organic transition metal salt - Carbene-type 1,3-dipolar compound - Organic metalloid moeity - Olefin - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Unsaturated hydrocarbon - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic salt - Unsaturated aliphatic hydrocarbon - Hydrocarbon - Organic cation - Aromatic homomonocyclic 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

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