Compound Identification
SMILES
CC1CC(=O)C(CC(=O)N2CCN(CC2)S(=O)(=O)C2=CC=CC(=C2)C(F)(F)F)C1C[N+]([O-])=O
InChIKey
InChIKey=DRHWYVUTMJLBFU-UHFFFAOYSA-N
Formula
C20H24F3N3O6S
Mass
491.48
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lipids and lipid-like molecules
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Class
Prenol lipids
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Subclass
Monoterpenoids
- Level 5 Iridoids and derivatives
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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
Iridoids and derivatives
Alternative Parents
Trifluoromethylbenzenes Aromatic monoterpenoids Benzenesulfonamides Monocyclic monoterpenoids Benzenesulfonyl compounds Organosulfonamides Piperazines Sulfonyls Tertiary carboxylic acid amides Cyclic ketones C-nitro compounds Tertiary amines Amino acids and derivatives Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organofluorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aromatic monoterpenoid - Benzenesulfonamide - Trifluoromethylbenzene - 11-noriridane monoterpenoid - Monocyclic monoterpenoid - Benzenesulfonyl group - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Organosulfonic acid amide - Benzenoid - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitro compound - Carboxamide group - Ketone - C-nitro compound - Cyclic ketone - Tertiary amine - Amino acid or derivatives - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Alkyl halide - Organic nitrogen compound - Organic salt - Carbonyl group - Organic oxygen compound - Organohalogen compound - Alkyl fluoride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Amine - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as iridoids and derivatives. These are monoterpenes containing a skeleton structurally characterized by the presence of a cylopentane fused to a pyran ( forming a 4,7-dimethylcyclopenta[c]pyran), or a derivative where the pentane moiety is open.
External Descriptors
Not available