BMMCBZ2Pf043
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
|SysName=4-Sulfo-benzoic acid | |SysName=4-Sulfo-benzoic acid | ||
| − | |Common Name=&&4-Sulfobenzoate&& | + | |Common Name=&&4-Sulfobenzoate&&4-Sulfo-benzoic acid&& |
|CAS=636-78-2 | |CAS=636-78-2 | ||
|KEGG=C02236 | |KEGG=C02236 | ||
}} | }} | ||
Latest revision as of 23:36, 3 February 2009
| Basic Metabolism Top (代謝トップ) |
Molecule Index (化合物索引) |
EC classes ( EC分類) |
Input New Data (新規入力) |
Upper classes : BM Basic Metabolites : BMMC mono- or assembled cycle 単、複合環 : BMMCBZ benzene ring ベンゼン環 : BMMCBZ2P with 2 substitutions (para) (64 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 636-78-2 |
| KEGG | C02236 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMMCBZ2Pf043.mol |
| 4-Sulfobenzoate | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 4-Sulfo-benzoic acid |
| Common Name |
|
| Symbol | |
| Formula | C7H6O5S |
| Exact Mass | 201.9935 |
| Average Mass | 202.1855 |
| SMILES | OC(=O)c(c1)ccc(c1)S(O)(=O)=O |
| Physicochemical Information | |
| Melting Point | |
| Boiling Point | |
| Density | |
| Optical Rotation | |
| Reflactive Index | |
| Solubility | |
| Spectral Information | |
| Mass Spectra | |
| UV Spectra | |
| IR Spectra | |
| NMR Spectra | |
| Chromatograms | |
Related Atomic Mappings, Enzymes, and Pathways
