Compound Identification
SMILES
COC(=O)C1CC[NH+](C[C@H](O)COC2=CC=CC(C[NH2+]CCCC3=CC=CC=C3)=C2)CC1
InChIKey
InChIKey=DPEINVWPQIMGDM-DEOSSOPVSA-P
Formula
C26H38N2O4
Mass
442.599
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylpropylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylpropylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpropylamines
Alternative Parents
Piperidinecarboxylic acids Benzylamines Phenol ethers Phenoxy compounds Phenylmethylamines Alkyl aryl ethers Aralkylamines Methyl esters Quaternary ammonium salts Amino acids and derivatives 1,2-aminoalcohols Trialkylamines Secondary alcohols Monocarboxylic acids and derivatives Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpropylamine - Piperidinecarboxylic acid - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Alkyl aryl ether - Aralkylamine - Piperidine - Quaternary ammonium salt - Methyl ester - Tertiary amine - Tertiary aliphatic amine - Secondary alcohol - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Secondary amine - Carboxylic acid derivative - Organoheterocyclic compound - Secondary aliphatic amine - Ether - Monocarboxylic acid or derivatives - Azacycle - Amine - Organic nitrogen compound - Alcohol - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpropylamines. These are compounds containing a phenylpropylamine moiety, which consists of a phenyl group substituted at the third carbon by an propan-1-amine.
External Descriptors
Not available