Structure Information
Structure

Compound Identification

SMILES

CC(O)C(O)=O.COC1=C(OC)C2=C(C=CC(C)(C)O2)C(CC2=CN=C(N)N=C2N)=C1

InChIKey

InChIKey=QOORKSWQVMNIAH-UHFFFAOYSA-N

Formula

C21H28N4O6

Mass

432.477

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

2,2-dimethyl-1-benzopyrans

Direct Parent

Precocenes

Alternative Parents

Molecular Framework

Not available

Substituents

Precocene - Phenol ether - Anisole - Aminopyrimidine - Alkyl aryl ether - Imidolactam - Benzenoid - Pyrimidine - Hydroxy acid - Alpha-hydroxy acid - Heteroaromatic compound - Secondary alcohol - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Alcohol - Organonitrogen compound - Organooxygen compound - Primary amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as precocenes. These are aromatic heteropolycyclic compounds that contain a 2,2-dimethyl-1-benzopyran moiety, which carries a methoxy group at the ring 7-position.

External Descriptors

Not available

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