Compound Identification
SMILES
C[C@@]12CN3C4[C@@H]5C[C@H]6[C@H](OC(=O)\C=C\C7=CC=CC=C7)[C@H]7[C@]4(CCC1)[C@@H]2[C@@]3(O)CC57[C@H](O)C6=C
InChIKey
InChIKey=RJZQOUOLLUXGKS-ORQGVBFASA-N
Formula
C29H33NO4
Mass
459.586
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
Cinnamic acid esters Azaspirodecane derivatives Quinolizidines Alkaloids and derivatives Indoles and derivatives Indolizidines Isoindolines Styrenes Azepanes Fatty acid esters N-alkylpyrrolidines Piperidines Enoate esters Hemiaminals Cyclic alcohols and derivatives Secondary alcohols Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Hetisine-type diterpenoid alkaloid - Cinnamic acid or derivatives - Cinnamic acid ester - Azaspirodecane - Quinolizidine - Indole or derivatives - Indolizidine - Alkaloid or derivatives - Isoindoline - Isoindole or derivatives - Styrene - Azepane - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Piperidine - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Cyclic alcohol - Secondary alcohol - Hemiaminal - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Alkanolamine - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Alcohol - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic 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