Compound Identification
SMILES
Cl.CC12CC(O)C(O)C34C5C6CC7CC3(O)C6(CC(C14)N5C2O)CC7=C
InChIKey
InChIKey=BBJOWYVIJZQIAZ-UHFFFAOYSA-N
Formula
C20H28ClNO4
Mass
381.9
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
-
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 Tertiary alcohols Hemiaminals Cyclic alcohols and derivatives Secondary alcohols Polyols Azacyclic compounds Hydrochlorides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Hetisine-type diterpenoid alkaloid - Azaspirodecane - Quinolizidine - Indole or derivatives - Alkaloid or derivatives - Indolizidine - Isoindoline - Isoindole or derivatives - Azepane - N-alkylpyrrolidine - Piperidine - Cyclic alcohol - Tertiary alcohol - Pyrrolidine - Hemiaminal - Secondary alcohol - Alkanolamine - Azacycle - Organoheterocyclic compound - Polyol - Hydrochloride - Hydrocarbon derivative - Organopnictogen compound - Organic oxygen compound - Alcohol - Organic nitrogen compound - Organonitrogen compound - Organooxygen 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