Compound Identification
SMILES
CC1=NC=C(CO)C(CNSC2=CC=C(C=C2)[N+]([O-])=O)=C1O
InChIKey
InChIKey=LNMBQHFFXHSRND-UHFFFAOYSA-N
Formula
C14H15N3O4S
Mass
321.35
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyridines and derivatives
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Subclass
Pyridoxamines
- Level 5 Pyridoxamine 5'-phosphates
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Subclass
Pyridoxamines
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Class
Pyridines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridoxamines
Intermediate Tree Nodes
Not available
Direct Parent
Pyridoxamine 5'-phosphates
Alternative Parents
Nitrobenzenes Nitroaromatic compounds Hydroxypyridines Methylpyridines Heteroaromatic compounds Sulfenyl compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organosulfenic acid amides Organic oxoazanium compounds Organic oxides Organic salts Organic zwitterions Hydrocarbon derivatives Organonitrogen compounds Primary alcohols Aromatic alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyridoxamine 5'-phosphate - Nitrobenzene - Nitroaromatic compound - Methylpyridine - Hydroxypyridine - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Sulfenyl compound - Azacycle - Organosulfenic acid amide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Alcohol - Organic zwitterion - Aromatic alcohol - Organic salt - Primary alcohol - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridoxamine 5'-phosphates. These are heterocyclic aromatic compounds containing a pyridoxamine that carries a phosphate group at the 5'-position.
External Descriptors
Not available