Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=C2O[C@H]3OC4=C(C(=O)[C@@](O)(CC(C)=O)C5=C4C=CC4=C5C=CC=C4C)[C@@]3(C)OC2=C2C[C@@]34CCCC(C)(C)[C@@H]3C[C@H](O4)C2=C1

InChIKey

InChIKey=CAOXTPMJXZFCFI-RDFLCCBXSA-N

Formula

C41H44O7

Mass

648.796

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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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Tanshinone skeleton - Hydroxysteroid - 12-oxosteroid - Oxosteroid - 11-beta-hydroxysteroid - 11-hydroxysteroid - Delta-7-steroid - 15-oxasteroid - Steroid - Phenanthrol - Phenanthrene - Naphthofuran - Isochromane - Benzopyran - Naphthalene - 2-benzopyran - Cumene - Alkyl aryl ether - Beta-hydroxy ketone - Benzenoid - Para-dioxin - Acyloin - Dihydrofuran - Tertiary alcohol - Vinylogous ester - Oxolane - Ketone - Organoheterocyclic compound - Oxacycle - Ether - Dialkyl ether - Acetal - Alcohol - Carbonyl group - Organic oxygen compound - Organooxygen compound - Aldehyde - Organic oxide - Hydrocarbon derivative - 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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