Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(C=C1C)N(C[C@@H](O)[C@@H](O)[C@@H](O)COP(O)(O)=S)C1=NC(=O)NC(=O)C1=N2

InChIKey

InChIKey=BVDKANIIUDRDSK-MBNYWOFBSA-N

Formula

C17H21N4O8PS

Mass

472.41

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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 - Diazanaphthalene - Quinoxaline - Pyrimidone - Benzenoid - Organic thiophosphoric acid or derivatives - Thiophosphate monoester - Pyrimidine - Pyrazine - Thiophosphoric acid ester - Monosaccharide - 1,2,5,6-tetrahydropyrimidine - Hydropyrimidine - Heteroaromatic compound - Secondary ketimine - Dicarboximide - Secondary alcohol - Carbonic acid derivative - Lactam - Ketimine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Imine - Alcohol - 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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