Compound Identification
SMILES
CC1=NC=C(COP(O)(=O)OP(O)(=O)OC2OC(CO)C(O)C(O)C2O)C(C=O)=C1O
InChIKey
InChIKey=KJBLIODYQVNYGC-UHFFFAOYSA-N
Formula
C14H21NO14P2
Mass
489.263
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
Hexoses Monosaccharide phosphates Organic pyrophosphates Aryl-aldehydes Monoalkyl phosphates Methylpyridines Hydroxypyridines Oxanes Vinylogous acids Heteroaromatic compounds 1,2-diols Secondary alcohols Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hexose monosaccharide - Pyridoxal - Monosaccharide phosphate - Organic pyrophosphate - Methylpyridine - Hydroxypyridine - Aryl-aldehyde - Monoalkyl phosphate - Monosaccharide - Organic phosphoric acid derivative - Oxane - Phosphoric acid ester - Alkyl phosphate - Vinylogous acid - Heteroaromatic compound - Secondary alcohol - 1,2-diol - Azacycle - Polyol - Oxacycle - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Alcohol - Organooxygen compound - Organic oxygen compound - Aldehyde - Organic nitrogen compound - Primary alcohol - 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