Compound Identification
SMILES
COC1=C(C)C=C2[C@@H]3C[C@@H](O)[C@@H](C(C)(C)O)[C@]3(C)CC[C@@H](C)C2=C1
InChIKey
InChIKey=FZENUYZVBHVPLY-GJQAKPAJSA-N
Formula
C21H32O3
Mass
332.484
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Prenol lipids
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Subclass
Diterpenoids
- Level 5 Sphaeroane diterpenoids
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Subclass
Diterpenoids
-
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
Sphaeroane diterpenoids
Alternative Parents
Anisoles Alkyl aryl ethers Tertiary alcohols Secondary alcohols Cyclic alcohols and derivatives Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Sphaeroane diterpenoid - Anisole - Alkyl aryl ether - Benzenoid - Tertiary alcohol - Cyclic alcohol - Secondary alcohol - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aromatic homopolycyclic compound
Description
This compound belongs to the class of organic compounds known as sphaeroane diterpenoids. These are diterpenoids with a structure based on the 3a,6,9-trimethyl-3-(propan-2-yl)-tetradecahydrocyclohexa[e]azulene skeleton or formally 2,7-cyclodolabellane.
External Descriptors
Not available