Compound Identification
SMILES
C[C@H]1[C@H](C)[C@@]2(C[C@H](O)CO2)O[C@@H]2[C@@H]1O[C@H]1C[C@H]3O[C@H]4C[C@H]5O[C@H]6C\C=C/C[C@H]7O[C@H]8CCCO[C@@H]8C[C@@H]7O[C@@H]6CC[C@@H]5O[C@@H]4CCC[C@@H]3O[C@@H]1[C@@H](C)[C@@H]2O
InChIKey
InChIKey=GVHXTZYCBTVOES-CWAABXFJSA-N
Formula
C42H64O12
Mass
760.962
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Ciguatera toxins
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Ciguatera toxins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Ciguatera toxins
Alternative Parents
Oxepanes Ketals Oxanes Monosaccharides Oxolanes Secondary alcohols Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Ciguatera toxin fragment - Ketal - Oxepane - Monosaccharide - Oxane - Oxolane - Secondary alcohol - Acetal - Dialkyl ether - Ether - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organooxygen compound - Organic oxygen compound - Alcohol - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as ciguatera toxins. These are lipid-soluble polyether compounds consisting of 13 to 14 rings fused by ether linkages into a most rigid ladder-like structure.
External Descriptors
Not available