Structure Information
Structure

Compound Identification

SMILES

C[C@@H](SP(O)(=O)O[C@H]1[C@H](O)[C@@H](OP(O)(O)=O)[C@@H](O)[C@@H](O)[C@@H]1OP(O)(O)=O)C1=CC=CC=C1[N+]([O-])=O

InChIKey

InChIKey=GPGJXNYNJPMDTP-MOWZACQSSA-N

Formula

C14H22NO16P3S

Mass

585.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Alcohols and polyols

Intermediate Tree Nodes

Cyclic alcohols and derivatives - Cyclitols and derivatives

Direct Parent

Inositol phosphates

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Inositol phosphate - Nitrobenzene - Nitroaromatic compound - Cyclohexanol - Monoalkyl phosphate - Monocyclic benzene moiety - Organic phosphoric acid derivative - Phosphoric acid ester - Benzenoid - Alkyl phosphate - C-nitro compound - Organic nitro compound - Secondary alcohol - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organothiophosphorus compound - Allyl-type 1,3-dipolar organic compound - Polyol - Sulfenyl compound - Organopnictogen compound - Organonitrogen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as inositol phosphates. These are compounds containing a phosphate group attached to an inositol (or cyclohexanehexol) moiety.

External Descriptors

Not available

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