Compound Identification
SMILES
CC1=C(O)C=CC2=C1OC(=O)C(CC(=O)N1CCCC3=C[C@H]4C[C@H](C[NH+]5CCCC[C@H]45)[C@H]13)=C2C
InChIKey
InChIKey=JSTREGLAPOVMCR-XOKJFZFGSA-O
Formula
C28H35N2O4
Mass
463.597
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Lupin alkaloids
- Subclass Aloperine and related alkaloids
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Class
Lupin alkaloids
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Lupin alkaloids
Subclass
Aloperine and related alkaloids
Intermediate Tree Nodes
Not available
Direct Parent
Aloperine and related alkaloids
Alternative Parents
7-hydroxycoumarins 1-benzopyrans Quinolizidines N-acylpiperidines 1-hydroxy-2-unsubstituted benzenoids Pyranones and derivatives Quaternary ammonium salts Heteroaromatic compounds Tertiary carboxylic acid amides Lactones Amino acids and derivatives Trialkylamines Azacyclic compounds Oxacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aloperine skeleton - 7-hydroxycoumarin - Hydroxycoumarin - Coumarin - Benzopyran - Quinolizidine - 1-benzopyran - N-acyl-piperidine - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Pyranone - Piperidine - Pyran - Benzenoid - Quaternary ammonium salt - Tertiary carboxylic acid amide - Heteroaromatic compound - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Lactone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Oxacycle - Amine - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as aloperine and related alkaloids. These are lupin Alkaloids with a structure based on the aloperine skeleton. Aloperine is a tetracyclic compound made up of a quinolizidine and a decahydroquinoline joined to form 3,15-diazatetracycloheptadecane.
External Descriptors
Not available