Compound Identification
SMILES
[H][H].C[C@@H]1CC[C@H]2[C@H](C)[C@@H](O[C@H]3O[C@]4(C)OC5(C)CC[C@H]6[C@H](C)CC[C@@H]([C@@H]3C)[C@@]46O5)O[C@@H]3OC4(C)CC[C@@H]1[C@@]23O4
InChIKey
InChIKey=URVNDLQWACSOET-UDEMOETASA-N
Formula
C31H50O7
Mass
534.734
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
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Secoiridoid-skeleton - Dioxolopyran - Ketal - Oxepane - Oxane - Meta-dioxolane - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic 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