Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(C=C1C)N(C[C@@H](OC(=O)C1=CN=CC=C1)[C@@H](OC(=O)C1=CN=CC=C1)[C@H](COC(=O)C1=CN=CC=C1)OC(=O)C1=CN=CC=C1)C1=NC(=O)NC(=O)C1=N2

InChIKey

InChIKey=TXGSMRRWACWHFZ-HWIYEDSRSA-N

Formula

C41H32N8O10

Mass

796.753

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pteridines and derivatives

Subclass

Alloxazines and isoalloxazines

Intermediate Tree Nodes

Not available

Direct Parent

Flavins

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavin - Tetracarboxylic acid or derivatives - Diazanaphthalene - Quinoxaline - Pyridine carboxylic acid - Pyridine carboxylic acid or derivatives - Pyrimidone - Pyrazine - Pyridine - Pyrimidine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Lactam - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavins. These are compounds containing a flavin (7,8-dimethyl-benzo[g]pteridine-2,4-dione) moiety, with a structure characterized by an isoalloaxzine tricyclic ring.

External Descriptors

Not available

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