Structure Information
Structure

Compound Identification

SMILES

CC[C@H](NC(=O)[C@@H]1C[C@@](C)(NC(=O)NC2=CC=CC(=C2)C(=O)OC)C2=NC=C(NCC3=CC(=CC=C3)C(F)(F)F)C(=O)N12)B1OC2C3CC(C[C@]2(C)O1)C3(C)C

InChIKey

InChIKey=QITCPPKBAVNIRZ-ISMAWZHCSA-N

Formula

C39H46BF3N6O7

Mass

778.64

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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

Direct Parent

Gamma amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Gamma amino acid or derivatives - N-phenylurea - Monoterpenoid - Nopinane monoterpenoid - Trifluoromethylbenzene - Benzoate ester - Aromatic monoterpenoid - Benzoic acid or derivatives - Benzylamine - Benzoyl - Phenylmethylamine - Secondary aliphatic/aromatic amine - Pyrimidone - Aralkylamine - Aminopyrimidine - Pyrimidine - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - 1,3,2-dioxaborolane - Boronic acid ester - Methyl ester - Lactam - Carbonic acid derivative - Boronic acid derivative - Carboxylic acid ester - Carboxamide group - Urea - Secondary carboxylic acid amide - Oxacycle - Azacycle - Organic metalloid salt - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Secondary amine - Alkyl fluoride - Organohalogen compound - Organoboron compound - Organofluoride - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alkylborane - Monoalkylborane - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom.

External Descriptors

Not available

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