Compound Identification
SMILES
[Ca++].[O-]C(=O)CCC\C=C\CC1C2CCC(C2)C1NS(=O)(=O)C1=CC=CC=C1.[O-]C(=O)CCC\C=C/CC1C2CCC(C2)C1NS(=O)(=O)C1=CC=CC=C1
InChIKey
InChIKey=CWOWCGMKFUVBRQ-ZMIPGMBUSA-L
Formula
C40H52CaN2O8S2
Mass
793.06
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Monoterpenoids
- Level 5 Aromatic monoterpenoids
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Subclass
Monoterpenoids
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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
Monoterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Aromatic monoterpenoids
Alternative Parents
Benzenesulfonamides Benzenesulfonyl compounds Medium-chain fatty acids Unsaturated fatty acids Organosulfonamides Aminosulfonyl compounds Carboxylic acid salts Organic calcium salts Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organic cations
Molecular Framework
Not available
Substituents
Aromatic monoterpenoid - Benzenesulfonamide - Benzenesulfonyl group - Medium-chain fatty acid - Monocyclic benzene moiety - Organosulfonic acid amide - Unsaturated fatty acid - Fatty acyl - Fatty acid - Benzenoid - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Aminosulfonyl compound - Carboxylic acid salt - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic calcium salt - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic salt - Organic cation - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as aromatic monoterpenoids. These are monoterpenoids containing at least one aromatic ring.
External Descriptors
Not available