Compound Identification
SMILES
COC1=C(O)C(Br)=C(CNCCC2=CC=C(O)C=C2)C=C1
InChIKey
InChIKey=MXDOLCXOJDVXEN-UHFFFAOYSA-N
Formula
C16H18BrNO3
Mass
352.228
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Amaryllidaceae alkaloids
Subclass
Norbelladine-type amaryllidaceae alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
Norbelladine-type amaryllidaceae alkaloids
Alternative Parents
Methoxyphenols Phenethylamines Phenylmethylamines Phenoxy compounds Anisoles O-bromophenols Methoxybenzenes Benzylamines 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Aralkylamines Bromobenzenes Aryl bromides Dialkylamines Hydrocarbon derivatives Organobromides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Norbelladine skeleton - Methoxyphenol - Phenethylamine - Anisole - Phenoxy compound - Benzylamine - 2-halophenol - 2-bromophenol - Methoxybenzene - Phenol ether - Phenylmethylamine - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - Bromobenzene - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Aralkylamine - Phenol - Aryl bromide - Aryl halide - Benzenoid - Monocyclic benzene moiety - Ether - Secondary aliphatic amine - Secondary amine - Organohalogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Amine - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as norbelladine-type amaryllidaceae alkaloids. These are amaryllidaceae alkaloids compounds containing the norbelladine skeleton. They are derived initially from the condensation of tyramine and protocatechuic aldehyde or its derivatives in plants.
External Descriptors
Not available