Compound Identification
SMILES
COC1=C(OC)C(OC)=C([18F])C(=C1)C1[C@@H]2[C@H](COC2=O)[C@H](OC2OC3COC(C)OC3C(O)C2O)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=GHGZVDSLMJHXIZ-QKODGRGCSA-N
Formula
C30H33FO13
Mass
619.582
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Lignans, neolignans and related compounds
-
Class
Lignan lactones
- Subclass Podophyllotoxins
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Class
Lignan lactones
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Superclass
Lignans, neolignans and related compounds
Kingdom
Organic compounds
Superclass
Lignans, neolignans and related compounds
Class
Lignan lactones
Subclass
Podophyllotoxins
Intermediate Tree Nodes
Not available
Direct Parent
Podophyllotoxins
Alternative Parents
Aryltetralin lignans Furanonaphthodioxoles Tetralins Pyranodioxins Benzodioxoles Phenoxy compounds Methoxybenzenes Anisoles Fluorobenzenes Alkyl aryl ethers Oxanes Gamma butyrolactones Aryl fluorides 1,3-dioxanes Monosaccharides Tetrahydrofurans Secondary alcohols Carboxylic acid esters 1,2-diols Oxacyclic compounds Acetals Monocarboxylic acids and derivatives Organic oxides Organofluorides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Podophyllotoxin - 1-aryltetralin lignan - Linear furanonaphthodioxole - Naphthofuran - Tetralin - Pyranodioxin - Benzodioxole - Anisole - Methoxybenzene - Phenol ether - Phenoxy compound - Alkyl aryl ether - Fluorobenzene - Halobenzene - Meta-dioxane - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Gamma butyrolactone - Monosaccharide - Oxane - Tetrahydrofuran - Lactone - Secondary alcohol - Carboxylic acid ester - 1,2-diol - Monocarboxylic acid or derivatives - Oxacycle - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Acetal - Organic oxygen compound - Alcohol - Carbonyl group - Organohalogen compound - Organofluoride - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as podophyllotoxins. These are tetralin lignans in which the benzene moiety of the tetralin skeleton is fused to a 1,3-dioxolane and the cyclohexane is fused to a butyrolactone (pyrrolidin-2-one).
External Descriptors
Not available