Compound Identification
SMILES
OCC1=CC[N+]2(CC3=CC=CC=C3)CC[C@H](O)[C@@H]12
InChIKey
InChIKey=MPDVSGSUYGUBLA-QMRHZFGWSA-N
Formula
C15H20NO2
Mass
246.329
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Not available
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Alkaloids and derivatives
Alternative Parents
Pyrrolizines Phenylmethylamines Benzylamines Aralkylamines N-alkylpyrrolidines Tetraalkylammonium salts Pyrrolines 1,3-aminoalcohols Secondary alcohols Azacyclic compounds Primary alcohols Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkaloid or derivatives - Benzylamine - Phenylmethylamine - Pyrrolizine - Aralkylamine - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - 1,3-aminoalcohol - Tetraalkylammonium salt - Pyrrolidine - Pyrroline - Quaternary ammonium salt - Secondary alcohol - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Amine - Primary alcohol - Alcohol - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as alkaloids and derivatives. These are naturally occurring chemical compounds that contain mostly basic nitrogen atoms. This group also includes some related compounds with neutral and even weakly acidic properties. Also some synthetic compounds of similar structure are attributed to alkaloids. In addition to carbon, hydrogen and nitrogen, alkaloids may also contain oxygen, sulfur and more rarely other elements such as chlorine, bromine, and phosphorus.
External Descriptors
Not available