Structure Information
Structure

Compound Identification

SMILES

COC(=O)N[C@@H](C(C)C)C(=O)NC(=O)[C@@H]1CCCN1C1=CC=C(C=C1)C1=CC=C(N1C1=CC=C(C=C1)C(C)(C)C)C1=CC=C(C=C1)C1=CN=C(N1)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OC)C(C)C

InChIKey

InChIKey=JHUOOMXDDZNMDN-HRBFTXTFSA-N

Formula

C52H64N8O7

Mass

913.133

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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

Valine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Proline or derivatives - Valine or derivatives - Alpha-amino acid amide - 1-phenylpyrrolidine - 1-phenylpyrrole - 2-phenylpyrrole - 4-phenylimidazole - 5-phenylimidazole - Phenylpropane - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-2-carboxamide - N-acylpyrrolidine - Benzenoid - Substituted pyrrole - Monocyclic benzene moiety - N-acyl-amine - Methylcarbamate - Azole - Carboxylic acid imide - Dicarboximide - Imidazole - Carboxylic acid imide, n-unsubstituted - Heteroaromatic compound - Carbamic acid ester - Tertiary carboxylic acid amide - Pyrrole - Pyrrolidine - Carboxamide group - Tertiary amine - Azacycle - Organoheterocyclic compound - Carbonyl group - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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