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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pteridines and derivatives
-
Subclass
Alloxazines and isoalloxazines
- Level 5 Flavins
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Subclass
Alloxazines and isoalloxazines
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Class
Pteridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pteridines and derivatives
Subclass
Alloxazines and isoalloxazines
Intermediate Tree Nodes
Not available
Direct Parent
Flavins
Alternative Parents
Quinoxalines Pyrimidones Thiophosphate monoesters Pyrazines Monosaccharides Hydropyrimidines Benzenoids Secondary ketimines Heteroaromatic compounds Dicarboximides Secondary alcohols Organic carbonic acids and derivatives Lactams Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
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