U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula 2C7H5O3.Zn.BH3O3
Molecular Weight 401.468
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZINC BORODISALICYLATE

SMILES

[Zn++].OB(O)O.OC1=C(C=CC=C1)C([O-])=O.OC2=C(C=CC=C2)C([O-])=O

InChI

InChIKey=PZYOGTKZBUEWKH-UHFFFAOYSA-L
InChI=1S/2C7H6O3.BH3O3.Zn/c2*8-6-4-2-1-3-5(6)7(9)10;2-1(3)4;/h2*1-4,8H,(H,9,10);2-4H;/q;;;+2/p-2

HIDE SMILES / InChI

Molecular Formula Zn
Molecular Weight 65.409
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H6O3
Molecular Weight 138.1207
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula BHO3
Molecular Weight 59.817
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct

Sample Use Guides

In Vivo Use Guide
Unknown
Route of Administration: Unknown
In Vitro Use Guide
Unknown
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:49:44 GMT 2023
Edited
by admin
on Fri Dec 15 15:49:44 GMT 2023
Record UNII
129S234L64
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ZINC BORODISALICYLATE
Common Name English
ZINCATE(3-), BIS(2-HYDROXYBENZOATO-O1,O2)(ORTHOBORATO(3-)-O)-, TRIHYDROGEN
Common Name English
Code System Code Type Description
PUBCHEM
76972695
Created by admin on Fri Dec 15 15:49:44 GMT 2023 , Edited by admin on Fri Dec 15 15:49:44 GMT 2023
PRIMARY
CAS
17083-53-3
Created by admin on Fri Dec 15 15:49:44 GMT 2023 , Edited by admin on Fri Dec 15 15:49:44 GMT 2023
PRIMARY
FDA UNII
129S234L64
Created by admin on Fri Dec 15 15:49:44 GMT 2023 , Edited by admin on Fri Dec 15 15:49:44 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE