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Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C1=CSC(=NC(P(O)(O)=O)P(O)(O)=O)N1CC=C

InChIKey

InChIKey=UJUPMTOMUWJFFQ-UHFFFAOYSA-N

Formula

C21H32N2O7P2S

Mass

518.5

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Organic phosphonic acids and derivatives

Subclass

Bisphosphonates

Intermediate Tree Nodes

Not available

Direct Parent

Bisphosphonates

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Bisphosphonate - Phenylpropane - Phenol - Monocyclic benzene moiety - Benzenoid - Azole - Organophosphonic acid - Thiazole - Heteroaromatic compound - Isothiourea - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organic oxide - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as bisphosphonates. These are organic compounds containing two phosphonate groups linked together through a carbon atoms.

External Descriptors

Not available

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