NE-58018

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H11NO7P2
Molecular Weight	283.1123
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(CC1=CC=CC=N1)(P(O)(O)=O)P(O)(O)=O

InChI

InChIKey=XXNASZAYANFLID-UHFFFAOYSA-N

InChI=1S/C7H11NO7P2/c9-7(16(10,11)12,17(13,14)15)5-6-3-1-2-4-8-6/h1-4,9H,5H2,(H2,10,11,12)(H2,13,14,15)

HIDE SMILES / InChI

Molecular Formula	C7H11NO7P2
Molecular Weight	283.1123
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Targets

Primary Target	Pharmacology	Condition	Potency
Farnesyl diphosphate synthase 28 Target ID: CHEMBL1782 Sources: https://www.ncbi.nlm.nih.gov/pubmed/18327899 \| https://www.ncbi.nlm.nih.gov/pubmed/14613320	Inhibitor 8504		9.2 nM [IC50]

PubMed

Title	Date	PubMed
Structure-activity relationships among the nitrogen containing bisphosphonates in clinical use and other analogues: time-dependent inhibition of human farnesyl pyrophosphate synthase.	2008-04-10	18327899

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:04:48 GMT 2025` Edited by `admin` on `Mon Mar 31 22:04:48 GMT 2025`
Record UNII	0QRY57BJCX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

RISEDRONATE RELATED COMPOUND A

Preferred Name

English

NE-58018

Common Name

English

RISEDRONATE 2-PYRIDINYL ISOMER

Common Name

English

RISEDRONATE RELATED COMPOUND A [USP-RS]

Common Name

English

(1-HYDROXY-2-(PYRIDIN-2-YL)ETHYLIDENE)BIS(PHOSPHONIC ACID)

Systematic Name

English

RISEDRONATE RELATED COMPOUND A [USP IMPURITY]

Common Name

English

RISEDRONATE SODIUM 2.5-HYDRATE IMPURITY B [EP IMPURITY]

Common Name

English

PHOSPHONIC ACID, P,P'-(1-HYDROXY-2-(2-PYRIDINYL)ETHYLIDENE)BIS-

Systematic Name

English

Code System Code Type Description

FDA UNII

0QRY57BJCX