Structure Information
Structure

Compound Identification

SMILES

N[C@H](COP(O)(O)=O)CC1=CN=CN1

InChIKey

InChIKey=CWNDERHTHMWBSI-YFKPBYRVSA-N

Formula

C6H12N3O4P

Mass

221.153

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Organic phosphoric acids and derivatives

Subclass

Phosphate esters

Intermediate Tree Nodes

Not available

Direct Parent

Phosphoethanolamines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phosphoethanolamine - Monoalkyl phosphate - Aralkylamine - Alkyl phosphate - Azole - Imidazole - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organic oxide - Primary amine - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phosphoethanolamines. These are compounds containing a phosphate linked to the second carbon of an ethanolamine.

External Descriptors

CHEBI:16996 : phosphoethanolamine

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