Compound Identification
SMILES
C[C@]12CC(=O)[C@@H]3C[C@@]1(O)[C@]3(CO)CO2
InChIKey
InChIKey=VUWIQYBIXGUMAJ-MCNGFCJOSA-N
Formula
C10H14O4
Mass
198.218
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
-
Subclass
Monoterpenoids
- Level 5 Bicyclic monoterpenoids
-
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
Bicyclic monoterpenoids
Alternative Parents
Oxepanes Tetrahydrofurans Tertiary alcohols Ketones Cyclic alcohols and derivatives Oxacyclic compounds Dialkyl ethers Primary alcohols Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Pinane monoterpenoid - Oxepane - Cyclic alcohol - Tertiary alcohol - Tetrahydrofuran - Cyclobutanol - Ketone - Ether - Dialkyl ether - Oxacycle - Organoheterocyclic compound - Primary alcohol - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Alcohol - Carbonyl group - Organic oxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as bicyclic monoterpenoids. These are monoterpenoids containing exactly 2 rings, which are fused to each other.
External Descriptors
Not available