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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H25FN6O6P.Na
Molecular Weight 530.4217
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FOBREPODACIN SODIUM

SMILES

[Na+].CCNC(=O)NC1=NC2=CC(C3=CN=C(N=C3)C(C)(C)OP(O)([O-])=O)=C(F)C([C@H]4CCCO4)=C2N1

InChI

InChIKey=LZPLFZIOJZSXGF-PFEQFJNWSA-M
InChI=1S/C21H26FN6O6P.Na/c1-4-23-20(29)28-19-26-13-8-12(16(22)15(17(13)27-19)14-6-5-7-33-14)11-9-24-18(25-10-11)21(2,3)34-35(30,31)32;/h8-10,14H,4-7H2,1-3H3,(H2,30,31,32)(H3,23,26,27,28,29);/q;+1/p-1/t14-;/m1./s1

HIDE SMILES / InChI

Molecular Formula Na
Molecular Weight 22.98976928
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C21H25FN6O6P
Molecular Weight 507.432
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 04:38:41 GMT 2025
Edited
by admin
on Wed Apr 02 04:38:41 GMT 2025
Record UNII
JX82N6UWU3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VXC-486 PHOSPHATE MONOSODIUM
Preferred Name English
FOBREPODACIN SODIUM
Common Name English
UREA, N-ETHYL-N'-(6-FLUORO-5-(2-(1-METHYL-1-(PHOSPHONOOXY)ETHYL)-5-PYRIMIDINYL)-7-((2R)-TETRAHYDRO-2-FURANYL)-1H-BENZIMIDAZOL-2-YL)-, SODIUM SALT (1:1)
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 727819
Created by admin on Wed Apr 02 04:38:42 GMT 2025 , Edited by admin on Wed Apr 02 04:38:42 GMT 2025
Code System Code Type Description
PUBCHEM
139593431
Created by admin on Wed Apr 02 04:38:42 GMT 2025 , Edited by admin on Wed Apr 02 04:38:42 GMT 2025
PRIMARY
CAS
1536471-76-7
Created by admin on Wed Apr 02 04:38:42 GMT 2025 , Edited by admin on Wed Apr 02 04:38:42 GMT 2025
PRIMARY
FDA UNII
JX82N6UWU3
Created by admin on Wed Apr 02 04:38:42 GMT 2025 , Edited by admin on Wed Apr 02 04:38:42 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY