Compound Identification
SMILES
CC1=C(COCC2=CC=CC=C2)[C@@]2(C)CC[C@@H]3C(C)(C)[C@@H](CC[C@@]3(C)[C@@H]2C[C@@H]1O)OCC1=CC=CC=C1
InChIKey
InChIKey=NUVRXRXHOQXLFA-CXDHSSNGSA-N
Formula
C34H46O3
Mass
502.739
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
- Subclass Diterpenoids
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Class
Prenol lipids
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Prenol lipids
Subclass
Diterpenoids
Intermediate Tree Nodes
Not available
Direct Parent
Isocopalane and spongiane diterpenoids
Alternative Parents
12-alpha-hydroxysteroids Hydrophenanthrenes Benzylethers Secondary alcohols Dialkyl ethers Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Isocopalane diterpenoid - 12-hydroxysteroid - Hydroxysteroid - 12-alpha-hydroxysteroid - Steroid - Phenanthrene - Hydrophenanthrene - Benzylether - Benzenoid - Monocyclic benzene moiety - Secondary alcohol - Ether - Dialkyl ether - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Alcohol - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as isocopalane and spongiane diterpenoids. These are diterpenoids with a structure based on the isocopalane (Tetradecahydro-1,1,4a,7,8,8a-hexamethylphenanthrene) or the 15,16-epoxyisocopalane skeleton.
External Descriptors
Not available