Structure Information
Structure

Compound Identification

SMILES

O[C@H]([C@@H](O)C(O)=O)C(O)=O.O=C1NCCCN1CCCNC[C@H]1CCC2=CC=CC=C2O1

InChIKey

InChIKey=DYCJDYCGRVTLKJ-KBYGAXRISA-N

Formula

C21H31N3O8

Mass

453.492

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzopyrans

Subclass

1-benzopyrans

Intermediate Tree Nodes

Not available

Direct Parent

1-benzopyrans

Alternative Parents

Molecular Framework

Not available

Substituents

1-benzopyran - Pyrimidone - Alkyl aryl ether - Short-chain hydroxy acid - Beta-hydroxy acid - Sugar acid - Aralkylamine - Monosaccharide - Pyrimidine - Hydroxy acid - Fatty acid - Benzenoid - Dicarboxylic acid or derivatives - 1,3-diazinane - Alpha-hydroxy acid - Secondary alcohol - 1,2-diol - Urea - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Oxacycle - Azacycle - Ether - Secondary amine - Alcohol - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.

External Descriptors

Not available

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