Compound Identification
SMILES
[H][C@]12N3C[C@]4(C)C[C@]([H])(O)C[C@]11[C@]5([H])C[C@@]6([H])C(=C)C[C@]5(C[C@@]3(O)[C@]41[H])[C@]2([H])[C@@]6([H])O
InChIKey
InChIKey=KXIKXHXMNJBYBP-IZUOMIDXSA-N
Formula
C20H27NO3
Mass
329.44
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
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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 Azaspirodecane derivatives Alkaloids and derivatives Indoles and derivatives Indolizidines Isoindolines Azepanes Piperidines N-alkylpyrrolidines Hemiaminals Cyclic alcohols and derivatives Secondary alcohols Polyols Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Hetisine-type diterpenoid alkaloid - Azaspirodecane - Quinolizidine - Indole or derivatives - Indolizidine - Isoindoline - Alkaloid or derivatives - Isoindole or derivatives - Azepane - Piperidine - N-alkylpyrrolidine - Pyrrolidine - Cyclic alcohol - Hemiaminal - Secondary alcohol - Polyol - Organoheterocyclic compound - Azacycle - Alkanolamine - Alcohol - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Organic nitrogen 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