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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4O5S.2H4N
Molecular Weight 236.246
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Diammonium 2-sulfobenzoate

SMILES

[NH4+].[NH4+].[O-]C(=O)C1=C(C=CC=C1)S([O-])(=O)=O

InChI

InChIKey=HYTQXUAMMSMMBW-UHFFFAOYSA-N
InChI=1S/C7H6O5S.2H3N/c8-7(9)5-3-1-2-4-6(5)13(10,11)12;;/h1-4H,(H,8,9)(H,10,11,12);2*1H3

HIDE SMILES / InChI

Molecular Formula H4N
Molecular Weight 18.0385
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C7H4O5S
Molecular Weight 200.169
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Pharmacokinetics and pharmacodynamics of dexamethasone sodium-m-sulfobenzoate (DS) after intravenous and intramuscular administration: a comparison with dexamethasone phosphate (DP).
2001 Apr
Synthesis of protected L-4-[sulfono(difluoromethyl)phenylalanine and its incorporation into a peptide.
2001 May 17
Structural confirmation of ostreocin-D by application of negative-ion fast-atom bombardment collision-induced dissociation tandem mass spectrometric methods.
2002
Bis(mu-2-sulfonatobenzoato)bis[(1,10-phenanthroline)lead(II)] dihydrate.
2004 Sep
The effect of histidine oxidation on the dissociation patterns of peptide ions.
2007 Mar
Facile Synthesis and Polymerization of 2,6-Difluoro-2'-sulfobenzophenone for Aromatic Proton Conducting Ionomers with Pendant Sulfobenzoyl Groups.
2010 Aug 3
Poly[[(2,2'-bipyridine)-(μ(3)-2-sulfonatobenzoato)lead(II)] dihydrate].
2010 Feb 17
De novo sequencing of two new cyclic theta-defensins from baboon (Papio hamadryas) leukocytes by matrix-assisted laser desorption/ionization mass spectrometry.
2010 Mar 15
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 09:38:02 GMT 2023
Edited
by admin
on Sat Dec 16 09:38:02 GMT 2023
Record UNII
GQ7PXL86DB
Record Status Validated (UNII)
Record Version
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Name Type Language
Diammonium 2-sulfobenzoate
Systematic Name English
Benzoic acid, o-sulfo-, diammonium salt
Common Name English
Benzoic acid, 2-sulfo-, diammonium salt
Common Name English
Benzoic acid, 2-sulfo-, ammonium salt (1:2)
Common Name English
Code System Code Type Description
FDA UNII
GQ7PXL86DB
Created by admin on Sat Dec 16 09:38:03 GMT 2023 , Edited by admin on Sat Dec 16 09:38:03 GMT 2023
PRIMARY
EPA CompTox
DTXSID70177435
Created by admin on Sat Dec 16 09:38:03 GMT 2023 , Edited by admin on Sat Dec 16 09:38:03 GMT 2023
PRIMARY
PUBCHEM
89894
Created by admin on Sat Dec 16 09:38:03 GMT 2023 , Edited by admin on Sat Dec 16 09:38:03 GMT 2023
PRIMARY
CAS
22895-07-4
Created by admin on Sat Dec 16 09:38:03 GMT 2023 , Edited by admin on Sat Dec 16 09:38:03 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE