Structure Information
Structure

Compound Identification

SMILES

C[C@H]1COC2=C1C(=O)[C@](O)(CC(C)=O)C1=C2C=CC2=C1C=CC=C2C

InChIKey

InChIKey=WQYKPUPMMFGHQW-QKVFXAPYSA-N

Formula

C21H20O4

Mass

336.387

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Taxonomic Classification

Taxonomy Tree

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

Oxosteroids 11-alpha-hydroxysteroids Oxasteroids and derivatives Delta-7-steroids Phenanthrols Naphthofurans Naphthalenes Beta-hydroxy ketones Acyloins Vinylogous esters Tertiary alcohols Dihydrofurans Oxacyclic compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Tanshinone skeleton - Hydroxysteroid - 12-oxosteroid - Oxosteroid - 11-alpha-hydroxysteroid - 11-hydroxysteroid - Delta-7-steroid - 15-oxasteroid - Steroid - Phenanthrol - Phenanthrene - Naphthofuran - Naphthalene - Benzenoid - Beta-hydroxy ketone - Acyloin - Tertiary alcohol - Vinylogous ester - Dihydrofuran - Ketone - Oxacycle - Organoheterocyclic compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organooxygen compound - 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

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