BMMCAS--d001
From Metabolomics.JP
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{{Metabolite | {{Metabolite | ||
| − | |SysName=1,1-Dichloro-2- (dihydroxy-4'- | + | |SysName=3-Chloro-6- [2,2-dichloro-1- (4-chlorophenyl) ethenyl] benzene-1,2-diol |
| − | + | |Common Name=&&1,1-Dichloro-2- (dihydroxy-4'-chlorophenyl) -2- (4'-chlorophenyl) ethylene&&1,1-Dichloro-2- (dihydroxy-4'-chorophenyl) -2- (4'-chlorophenyl) -ethylene&& | |
| − | |CAS= | + | |CAS=209783-04-0 |
|KEGG=C06644 | |KEGG=C06644 | ||
}} | }} | ||
Latest revision as of 15:28, 17 June 2010
| 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 : BMMCAS assembled 複合環 (15 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 209783-04-0 |
| KEGG | C06644 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMMCAS--d001.mol |
| 1,1-Dichloro-2- (dihydroxy-4'-chlorophenyl) -2- (4'-chlorophenyl) ethylene | |
|---|---|
| |
| Structural Information | |
| Systematic Name | 3-Chloro-6- [2,2-dichloro-1- (4-chlorophenyl) ethenyl] benzene-1,2-diol |
| Common Name |
|
| Symbol | |
| Formula | C14H8Cl4O2 |
| Exact Mass | 347.9278 |
| Average Mass | 350.0229 |
| SMILES | Clc(c2)ccc(c2)C(=C(Cl)Cl)c(c1)c(O)c(O)c(Cl)c1 |
| 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
