Compound Identification
SMILES
[Fe].[C-]#[O+].[C-]#[O+].CCOC(=O)NN(P\C(=C/[C]1[C](C)[C](C)[C](C)[C]1C)N(C)C)C(=O)OCC
InChIKey
InChIKey=WXVDYCNWIHSFIN-UHFFFAOYSA-N
Formula
C21H31FeN3O6P
Mass
508.313
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Monoterpenoids
- Level 5 Iridoids and derivatives
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Subclass
Monoterpenoids
-
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
Monocyclic monoterpenoids Tertiary amines Ketene acetals Organic transition metal salts Organophosphorus compounds Organic zwitterions Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
11-noriridane monoterpenoid - Monocyclic monoterpenoid - Ketene acetal or derivatives - Tertiary amine - Organic transition metal salt - Organic salt - Organic zwitterion - Hydrocarbon derivative - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Amine - Aliphatic homomonocyclic 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