Compound Identification
SMILES
CC(CC\C=C(\CO)C(O)=O)[C@H]1CCC2C3CCC4[C@]5(C[C@@]35CC[C@]12C)CCC(=O)C4(C)C
InChIKey
InChIKey=SIODMRVMIUILPW-XEMWPRARSA-N
Formula
C29H44O4
Mass
456.667
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
Monohydroxy bile acids, alcohols and derivatives Steroid acids Hydroxysteroids 3-oxosteroids Medium-chain fatty acids Hydroxy fatty acids Beta hydroxy acids and derivatives Unsaturated fatty acids Cyclic ketones Monocarboxylic acids and derivatives Carboxylic acids Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Triterpenoid - 26-hydroxysteroid - Cholane-skeleton - Monohydroxy bile acid, alcohol, or derivatives - Hydroxy bile acid, alcohol, or derivatives - Bile acid, alcohol, or derivatives - Steroid acid - Oxosteroid - 3-oxosteroid - Steroid - Medium-chain fatty acid - Hydroxy fatty acid - Beta-hydroxy acid - Fatty acyl - Fatty acid - Unsaturated fatty acid - Hydroxy acid - Cyclic ketone - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary alcohol - 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