Compound Identification
SMILES
C[C@H](CC(C)C(O)=O)C1CC(=O)[C@@]2(C)C3=C(C(=O)CC12C)C1(C)CCC(O)C(C)(C)C1CC3O
InChIKey
InChIKey=NIJXBMZGHRDDKR-LCGZKEFLSA-N
Formula
C28H42O6
Mass
474.638
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Triterpenoids
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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
Triterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Triterpenoids
Alternative Parents
Dihydroxy bile acids, alcohols and derivatives 7-hydroxysteroids 3-hydroxysteroids 14-alpha-methylsteroids 11-oxosteroids Cyclohexenones Secondary alcohols Cyclic alcohols and derivatives Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Triterpenoid - Dihydroxy bile acid, alcohol, or derivatives - Hydroxy bile acid, alcohol, or derivatives - Bile acid, alcohol, or derivatives - 14-alpha-methylsteroid - 7-hydroxysteroid - Oxosteroid - 15-oxosteroid - 11-oxosteroid - Hydroxysteroid - 3-hydroxysteroid - Steroid - Cyclohexenone - Cyclic alcohol - Secondary alcohol - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as triterpenoids. These are terpene molecules containing six isoprene units.
External Descriptors
Not available