VXH

pyridine-3-sulfonic acid

Created:	2023-04-12
Last modified:	2024-01-24

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1 entries where VXH is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	15
Chiral Atom Count	0
Bond Count	15
Aromatic Bond Count	6

2D diagram of VXH

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Chemical Component Summary
Name	pyridine-3-sulfonic acid
Systematic Name (OpenEye OEToolkits)	pyridine-3-sulfonic acid
Formula	C₅ H₅ N O₃ S
Molecular Weight	159.163
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O[S](=O)(=O)c1cccnc1
SMILES	OpenEye OEToolkits	2.0.7	c1cc(cnc1)S(=O)(=O)O
Canonical SMILES	CACTVS	3.385	O[S](=O)(=O)c1cccnc1
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc(cnc1)S(=O)(=O)O
InChI	InChI	1.06	InChI=1S/C5H5NO3S/c7-10(8,9)5-2-1-3-6-4-5/h1-4H,(H,7,8,9)
InChIKey	InChI	1.06	DVECLMOWYVDJRM-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL4438353
PubChem	69468, 1549497
ChEMBL	CHEMBL4438353
CCDC/CSD	PYSULA01, RAFVIF, DUTTOC, RAFVOL

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.