NOBERASTINE CITRATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H21N5O.C6H8O7
Molecular Weight	503.5051
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.CC1=CC=C(CN2C(NC3CCNCC3)=NC4=C2N=CC=C4)O1

InChI

InChIKey=VXIJMTRTCJNTMW-UHFFFAOYSA-N

InChI=1S/C17H21N5O.C6H8O7/c1-12-4-5-14(23-12)11-22-16-15(3-2-8-19-16)21-17(22)20-13-6-9-18-10-7-13;7-3(8)1-6(13,5(11)12)2-4(9)10/h2-5,8,13,18H,6-7,9-11H2,1H3,(H,20,21);13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C6H8O7
Molecular Weight	192.1235
Charge	0
Count

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

Molecular Formula	C17H21N5O
Molecular Weight	311.3815
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:04:32 GMT 2025` Edited by `admin` on `Mon Mar 31 18:04:32 GMT 2025`
Record UNII	2T9WRO4KJM
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NOBERASTINE CITRATE

Common Name

English

R-83546

Preferred Name

English

Code System Code Type Description

PUBCHEM

21695212

Created by admin on Mon Mar 31 18:04:32 GMT 2025 , Edited by admin on Mon Mar 31 18:04:32 GMT 2025

PRIMARY

FDA UNII

2T9WRO4KJM

Created by admin on Mon Mar 31 18:04:32 GMT 2025 , Edited by admin on Mon Mar 31 18:04:32 GMT 2025

PRIMARY

CAS

139751-07-8

Created by admin on Mon Mar 31 18:04:32 GMT 2025 , Edited by admin on Mon Mar 31 18:04:32 GMT 2025

PRIMARY

Related Record Type Details


					9HPD98OUWN

NOBERASTINE

PARENT -> SALT/SOLVATE


					XF417D3PSL

Anhydrous citric acid

PARENT -> SALT/SOLVATE