Structure Information
Structure

Compound Identification

SMILES

C[C@@H](N)CC1=C(C=C(CCB(O)O)C=C1)C(O)=O

InChIKey

InChIKey=CQRDNKDEGQTCQD-MRVPVSSYSA-N

Formula

C12H18BNO4

Mass

251.09

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenethylamines

Intermediate Tree Nodes

Not available

Direct Parent

Amphetamines and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Amphetamine or derivatives - Benzoic acid or derivatives - Benzoic acid - Phenylpropane - Benzoyl - Aralkylamine - Amino acid or derivatives - Boronic acid derivative - Amino acid - Boronic acid - Organic metalloid salt - Carboxylic acid derivative - Carboxylic acid - Amine - Organonitrogen compound - Organic metalloid moeity - Primary aliphatic amine - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Alkylborane - Monoalkylborane - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as amphetamines and derivatives. These are organic compounds containing or derived from 1-phenylpropan-2-amine.

External Descriptors

Not available

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