Compound Identification
SMILES
C[C@H]1COC2=C1C(=O)[C@](O)(CC(C)=O)C1=C2C=CC2=C1CCCC2(C)C
InChIKey
InChIKey=KZLPKGGMSDHTRS-YTEVENLXSA-N
Formula
C22H26O4
Mass
354.446
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
Tanshinones, isotanshinones, and derivatives
Alternative Parents
11-alpha-hydroxysteroids Oxosteroids Delta-5-steroids Delta-7-steroids Oxasteroids and derivatives Phenanthrols Naphthofurans Naphthalenes Tetralins Beta-hydroxy ketones Acyloins Dihydrofurans Vinylogous esters Tertiary alcohols Oxacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tanshinone skeleton - Hydroxysteroid - 12-oxosteroid - Oxosteroid - 11-alpha-hydroxysteroid - 11-hydroxysteroid - Delta-5-steroid - Delta-7-steroid - 15-oxasteroid - Steroid - Phenanthrol - Phenanthrene - Naphthofuran - Tetralin - Naphthalene - Benzenoid - Beta-hydroxy ketone - Acyloin - Tertiary alcohol - Vinylogous ester - Dihydrofuran - Ketone - Organoheterocyclic compound - Oxacycle - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Alcohol - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tanshinones, isotanshinones, and derivatives. These are a group of abietane-type norditerpenoid quinones.
External Descriptors
Not available