Structure Information
Structure

Compound Identification

SMILES

CC1=C(Cl)C(=O)OC2=C1C=CC1=C2[C@@H](OC(=O)C23CCC(C)(C(=O)O2)C3(C)C)[C@@H](OC(=O)C23CCC(C)(C(=O)O2)C3(C)C)C(C)(C)O1

InChIKey

InChIKey=PJOCQUFJLKSOCE-QMYDHGACSA-N

Formula

C35H39ClO11

Mass

671.14

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Coumarins and derivatives

Subclass

Pyranocoumarins

Intermediate Tree Nodes

Not available

Direct Parent

Angular pyranocoumarins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Angular pyranocoumarin - Pyranochromene - Tetracarboxylic acid or derivatives - 2,2-dimethyl-1-benzopyran - 1-benzopyran - Benzopyran - Chromane - Delta_valerolactone - Alkyl aryl ether - Pyranone - Delta valerolactone - Aryl halide - Aryl chloride - Pyran - Oxane - Benzenoid - Gamma butyrolactone - Heteroaromatic compound - Tetrahydrofuran - Carboxylic acid ester - Lactone - Ether - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Organochloride - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as angular pyranocoumarins. These are organic compounds containing a pyran (or a hydrogenated derivative) angularly fused to a coumarin moiety.

External Descriptors

Not available

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