Structure Information
Structure

Compound Identification

SMILES

CC1=CC2=C(C=C1C)N(C1=C(NC(=O)NC1=O)N2C[C@H](O)[C@H](O)[C@H](O)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1N=CN=C2N)S(O)(=O)=O

InChIKey

InChIKey=DNHISRBGMCVSPB-UYBVJOGSSA-N

Formula

C27H35N9O18P2S

Mass

867.63

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Nucleosides, nucleotides, and analogues

Class

Flavin nucleotides

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Flavin nucleotides

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Flavin nucleotide - Purine ribonucleoside diphosphate - Purine ribonucleoside monophosphate - Flavin - Pentose-5-phosphate - Pentose phosphate - Alkyldiarylamine - Glycosyl compound - N-glycosyl compound - 6-aminopurine - Pteridine - Pentose monosaccharide - Monosaccharide phosphate - Organic pyrophosphate - Imidazopyrimidine - Purine - Monoalkyl phosphate - Pyrimidone - Aminopyrimidine - Monosaccharide - N-substituted imidazole - Organic phosphoric acid derivative - Sulfuric acid monoamide - Imidolactam - Benzenoid - Phosphoric acid ester - Alkyl phosphate - Pyrimidine - Vinylogous amide - Tetrahydrofuran - Organic sulfuric acid or derivatives - Azole - Heteroaromatic compound - Imidazole - Secondary alcohol - Urea - Lactam - Polyol - Organoheterocyclic compound - Oxacycle - Azacycle - Amine - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organic oxide - Organooxygen compound - Alcohol - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as flavin nucleotides. These are nucleotides containing a flavin moiety. Flavin is a compound that contains the tricyclic isoalloxazine ring system, which bears 2 oxo groups at the 2- and 4-positions.

External Descriptors

CHEBI:45686 : sulfamic acids - flavin adenine dinucleotide

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