Compound Identification
SMILES
[H][C@@]12C[C@@]3([H])C[C@@]4([H])[C@]56[C@]1([H])N1C[C@](C)(CC[C@@]5([H])O)[C@@]6([H])[C@]1([H])[C@@]([H])(O)[C@@]24[C@]([H])(O)C3=C
InChIKey
InChIKey=UINWMICHSUQODN-PDXCJZOUSA-N
Formula
C20H27NO3
Mass
329.44
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
Azaspirodecane derivatives Quinolizidines Alkaloids and derivatives Indoles and derivatives Indolizidines Isoindolines Azepanes Piperidines N-alkylpyrrolidines Cyclic alcohols and derivatives 1,2-aminoalcohols Secondary alcohols Trialkylamines Polyols Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Hetisine-type diterpenoid alkaloid - Azaspirodecane - Quinolizidine - Indole or derivatives - Indolizidine - Isoindoline - Isoindole or derivatives - Alkaloid or derivatives - Azepane - N-alkylpyrrolidine - Piperidine - Cyclic alcohol - Pyrrolidine - Tertiary amine - 1,2-aminoalcohol - Tertiary aliphatic amine - Secondary alcohol - Azacycle - Polyol - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organic oxygen compound - 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