Compound Identification
SMILES
C[C@]12CN3[C@H]4C[C@@]56C7C[C@@H](C[C@H]5[C@@](C37)([C@@H]14)C(=O)CC2)C(=C)C6=O
InChIKey
InChIKey=MQQDCHYVXYEUIQ-DBKXRDQPSA-N
Formula
C20H23NO2
Mass
309.409
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Diterpenoids
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Class
Prenol lipids
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Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Diterpenoids
Intermediate Tree Nodes
Villanovane, atisane, trachylobane or helvifulvane diterpenoids - Atisane diterpenoids
Direct Parent
Hetisine-type diterpenoid alkaloids
Alternative Parents
Quinolizidines Isoindolones Azaspirodecane derivatives Indolizidines Indoles and derivatives Alkaloids and derivatives Azepanes Piperidines N-alkylpyrrolidines Trialkylamines Ketones Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Hetisine-type diterpenoid alkaloid - Azaspirodecane - Isoindolone - Quinolizidine - Indole or derivatives - Indolizidine - Isoindoline - Isoindole or derivatives - Alkaloid or derivatives - Azepane - N-alkylpyrrolidine - Piperidine - Pyrrolidine - Ketone - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hetisine-type diterpenoid alkaloids. These are alkaloid diterpenoids with a structure based on the hetisine skeleton, which is a heptacyclic compound with an additional N-C-6 bond as compared with the hetidine-type, and thus, is one of most complex entries in the atisane-class.
External Descriptors
Not available