Compound Identification
SMILES
C[C@H]1C[C@@H](O)[C@]23[C@@H](C)CC[C@H]2[C@@H]2[C@@](C)(C[C@H](O)C(=O)C(C)(O)CO)CC[C@]2(C)C=C13
InChIKey
InChIKey=KRCDOLUIAIXHMA-WBBJEQSBSA-N
Formula
C25H40O5
Mass
420.59
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Monoterpenoids
- Level 5 Iridoids and derivatives
-
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
Fatty alcohols Monosaccharides Beta-hydroxy ketones Acyloins Tertiary alcohols Alpha-hydroxy ketones Secondary alcohols Cyclic alcohols and derivatives Polyols Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
11-noriridane monoterpenoid - Fatty alcohol - Acyloin - Beta-hydroxy ketone - Fatty acyl - Monosaccharide - Alpha-hydroxy ketone - Cyclic alcohol - Tertiary alcohol - Secondary alcohol - Ketone - Polyol - Hydrocarbon derivative - Alcohol - Carbonyl group - Organic oxide - Organic oxygen compound - Organooxygen compound - Primary alcohol - Aliphatic homopolycyclic 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