Compound Identification
SMILES
[Na+].C[C@@]12CC[C@H]([C@H]1CC[C@@]1(C)[C@H]2CC2=C(O)C=CC(OS([O-])(=O)=O)=C12)[C@@]1(C)CC[C@@H]2O[C@@]3(C)CCCC(C)(C)[C@@H]3CC[C@@]12C
InChIKey
InChIKey=PCBSAWPJRVFEMG-ZNVYDPJTSA-M
Formula
C36H53NaO6S
Mass
636.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Sesterterpenoids
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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
Sesterterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Sesterterpenoids
Alternative Parents
Fluorenes Arylsulfates Indanes Oxepanes 1-hydroxy-2-unsubstituted benzenoids Sulfuric acid monoesters Oxacyclic compounds Dialkyl ethers Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Sesterterpenoid - Fluorene - Arylsulfate - Indane - 1-hydroxy-2-unsubstituted benzenoid - Oxepane - Phenol - Sulfuric acid monoester - Sulfate-ester - Benzenoid - Sulfuric acid ester - Organic sulfuric acid or derivatives - Dialkyl ether - Ether - Oxacycle - Organic alkali metal salt - Organoheterocyclic compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic sodium salt - Organic oxide - Organic salt - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as sesterterpenoids. These are terpenes composed of five consecutive isoprene units.
External Descriptors
Not available