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Details

Stereochemistry ACHIRAL
Molecular Formula C17H21N5O.C4H4O4
Molecular Weight 427.4537
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NOBERASTINE MALEATE

SMILES

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

InChI

InChIKey=CIILAEPYXFBPRG-BTJKTKAUSA-N
InChI=1S/C17H21N5O.C4H4O4/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;5-3(6)1-2-4(7)8/h2-5,8,13,18H,6-7,9-11H2,1H3,(H,20,21);1-2H,(H,5,6)(H,7,8)/b;2-1-

HIDE SMILES / InChI

Molecular Formula C4H4O4
Molecular Weight 116.0722
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
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 Fri Dec 15 15:58:20 GMT 2023
Edited
by admin
on Fri Dec 15 15:58:20 GMT 2023
Record UNII
WAYB7MW5R0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NOBERASTINE MALEATE
Common Name English
3H-IMIDAZO(4,5-B)PYRIDIN-2-AMINE, 3-((5-METHYL-2-FURANYL)METHYL)-N-4-PIPERIDINYL-, (2Z)-2-BUTENEDIOATE (1:2)
Systematic Name English
Code System Code Type Description
CAS
111922-05-5
Created by admin on Fri Dec 15 15:58:20 GMT 2023 , Edited by admin on Fri Dec 15 15:58:20 GMT 2023
PRIMARY
PUBCHEM
23623612
Created by admin on Fri Dec 15 15:58:20 GMT 2023 , Edited by admin on Fri Dec 15 15:58:20 GMT 2023
PRIMARY
FDA UNII
WAYB7MW5R0
Created by admin on Fri Dec 15 15:58:20 GMT 2023 , Edited by admin on Fri Dec 15 15:58:20 GMT 2023
PRIMARY
Related Record Type Details
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