Compound Identification
SMILES
COC1=CC(C)=CC2=C1C(C)=C(CC(=O)N1CCCC3=C[C@@H]4C[C@@H](C[NH+]5CCCC[C@H]45)[C@H]13)C(=O)O2
InChIKey
InChIKey=GVZKSVPLOKPVRT-RUZSSMJPSA-O
Formula
C29H37N2O4
Mass
477.624
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
Coumarins and derivatives Quinolizidines 1-benzopyrans N-acylpiperidines Anisoles Pyranones and derivatives Alkyl aryl ethers Tertiary carboxylic acid amides Quaternary ammonium salts Heteroaromatic compounds Trialkylamines Amino acids and derivatives Lactones Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aloperine skeleton - Coumarin - Benzopyran - Quinolizidine - 1-benzopyran - N-acyl-piperidine - Anisole - Phenol ether - Alkyl aryl ether - 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 - Carboxylic acid derivative - Azacycle - Ether - Oxacycle - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organic oxide - Organonitrogen 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