Compound Identification
SMILES
CC1=C(O)C(C=O)=C(CO)C(=N1)P(O)(O)=O
InChIKey
InChIKey=XFMARTUSKBLOEF-UHFFFAOYSA-N
Formula
C8H10NO6P
Mass
247.143
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
-
Subclass
Pyridine carboxaldehydes
- Level 5 Pyridoxals and derivatives
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Subclass
Pyridine carboxaldehydes
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridine carboxaldehydes
Intermediate Tree Nodes
Not available
Direct Parent
Pyridoxals and derivatives
Alternative Parents
Methylpyridines Hydroxypyridines Aryl-aldehydes Vinylogous acids Organic phosphonic acids Heteroaromatic compounds Azacyclic compounds Primary alcohols Organophosphorus compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridoxal - Methylpyridine - Hydroxypyridine - Aryl-aldehyde - Organophosphonic acid - Organophosphonic acid derivative - Heteroaromatic compound - Vinylogous acid - Azacycle - Alcohol - Hydrocarbon derivative - Aromatic alcohol - Organic oxide - Primary alcohol - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Aldehyde - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridoxals and derivatives. These are compounds containing a pyridoxal moiety, which consists of a pyridine ring substituted at positions 2,3,4, and 5 by a methyl group, a hydroxyl group, a carbaldehyde group, and a hydroxymethyl group, respectively.
External Descriptors
Not available