Compound Identification
SMILES
FC1C(F)(C2CCCCC2)C(F)(C2CCCCC2)C(F)(C2CCCCC2)C(OC2=CC=CC=C2)(C2CCCCC2)C1(C1CCCCC1)C1=C(F)C(F)=C(F)C=C1
InChIKey
InChIKey=XXOYFNPPSSZDGJ-UHFFFAOYSA-N
Formula
C48H63F7O
Mass
789.02
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Sesquiterpenoids
- Level 5 Elemane sesquiterpenoids
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Subclass
Sesquiterpenoids
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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
Sesquiterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Elemane sesquiterpenoids
Alternative Parents
Phenoxy compounds Phenol ethers Fluorobenzenes Cyclohexyl halides Alkyl aryl ethers Vinyl fluorides Fluoroalkenes Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Elemane sesquiterpenoid - Phenoxy compound - Phenol ether - Cyclohexyl halide - Halobenzene - Fluorobenzene - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Fluoroalkene - Haloalkene - Vinyl halide - Vinyl fluoride - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as elemane sesquiterpenoids. These are sesquiterpenoids with a structure based on the elemane skeleton. Elemane is a monocyclic compound consisting of a cyclohexane ring substituted with a methyl group, an ethyl group, and two 1-methylethyl groups at the 1-, 1-, 2-, and 4-position, respectively.
External Descriptors
Not available