Compound Identification
SMILES
CCN(CCC(=O)NC)C(=O)[C@H]1CN(C)C2CC3(O)C(=O)NC4=CC=CC(=C34)C2=C1
InChIKey
InChIKey=PPKFDRJVISCJLT-PENBGAGESA-N
Formula
C22H28N4O4
Mass
412.49
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Alkaloids and derivatives
-
Class
Ergoline and derivatives
- Subclass Lysergic acids and derivatives
-
Class
Ergoline and derivatives
-
Superclass
Alkaloids and derivatives
Kingdom
Organic compounds
Superclass
Alkaloids and derivatives
Class
Ergoline and derivatives
Subclass
Lysergic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Lysergic acids and derivatives
Alternative Parents
6,7-secoergolines Benzoquinolines Quinoline-3-carboxamides Beta amino acids and derivatives Tetralins Isoindolones Indolines Aralkylamines Tertiary carboxylic acid amides Tertiary alcohols Lactams Trialkylamines Secondary carboxylic acid amides Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Lysergic acid or derivatives - 6,7-secoergoline - Benzoquinoline - Quinoline-3-carboxamide - Beta amino acid or derivatives - Isoindolone - Tetralin - Quinoline - Indole or derivatives - Dihydroindole - Isoindole or derivatives - Aralkylamine - Benzenoid - Tertiary carboxylic acid amide - Tertiary alcohol - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Lactam - Tertiary amine - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as lysergic acids and derivatives. These are alkaloids with a structure based on the lysergic acid skeleton.
External Descriptors
Not available