Compound Identification
SMILES
COC1=C(C=C2C(NC(=O)C(C)Br)C3OC(=O)C4(CCCC(C)(C)C34)C2=C1OC)C(C)C
InChIKey
InChIKey=UBZNABHWEBOHFW-UHFFFAOYSA-N
Formula
C25H34BrNO5
Mass
508.453
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Terpene lactones
- Level 5 Diterpene lactones
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Subclass
Terpene lactones
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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
Terpene lactones
Intermediate Tree Nodes
Not available
Direct Parent
Diterpene lactones
Alternative Parents
Diterpenoids Phenanthrenes and derivatives Benzoxepines Tetralins Cumenes Anisoles Alkyl aryl ethers Gamma butyrolactones Oxolanes Secondary carboxylic acid amides Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides Alkyl bromides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Diterpene lactone - Diterpenoid - Phenanthrene - Benzoxepine - Tetralin - Cumene - Anisole - Phenol ether - Alkyl aryl ether - Benzenoid - Gamma butyrolactone - Oxolane - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Lactone - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Alkyl halide - Alkyl bromide - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organonitrogen compound - Organic oxygen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as diterpene lactones. These are diterpenoids containing a lactone moiety.
External Descriptors
Not available