Structure Information
Structure

Compound Identification

SMILES

C[C@@H]1C[C@@H](OC1=O)C1=CC=C2[C@@H]3[C@@H](C)[C@@H](O[C@H]3CCCN12)[C@H]1OC(=O)C(C)=C1

InChIKey

InChIKey=JAIHEXISEDXFLY-KJDHEDDBSA-N

Formula

C22H27NO5

Mass

385.46

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrroloazepines

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Pyrroloazepines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Pyrroloazepine - Azepine - 2-furanone - Dicarboxylic acid or derivatives - Gamma butyrolactone - Substituted pyrrole - Heteroaromatic compound - Dihydrofuran - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrrole - Oxolane - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Dialkyl ether - Oxacycle - Ether - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as pyrroloazepines. These are compounds containing a pyrroloazepine moiety, which is a bicyclic heterocycle which consists of a pyrrole ring fused to an azepine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Azepine is a 7-membered ring consisting of six carbon and one nitrogen atom.

External Descriptors

Not available

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