Compound Identification
SMILES
COC(=O)C1(C)CCC2(C)CCC3(C)C4=CC=C5C(C)=C(OS(O)(=O)=O)C(=O)C=C5C4(C)CCC3(C)C2C1
InChIKey
InChIKey=PAPPHQGNNLSBKJ-UHFFFAOYSA-N
Formula
C30H40O7S
Mass
544.7
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Triterpenoids
-
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
Sulfated steroids Sulfuric acid monoesters Methyl esters Cyclic ketones Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
Triterpenoid - Sulfated steroid skeleton - Sulfuric acid monoester - Sulfate-ester - Sulfuric acid ester - Methyl ester - Organic sulfuric acid or derivatives - Ketone - Carboxylic acid ester - Cyclic ketone - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - 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