BMCCID--k005
From Metabolomics.JP
| 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 : BMCC Conjugated cycle 共役環 : BMCCID indole インドール (34 pages)
| IDs and Links | |
|---|---|
| LipidBank | [1] |
| LipidMaps | [2] |
| CAS | 18766-67-1 |
| KEGG | C05604 |
| KNApSAcK | |
| CDX file | |
| MOL file | BMCCID--k005.mol |
| 2-Carboxy-2,3-dihydro-5,6-dihydroxyindole | |
|---|---|
| |
| Structural Information | |
| Systematic Name | (2S) -5,6-Dihydroxy-2,3-dihydro-1H-indole-2-carboxylic acid |
| Common Name |
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| Symbol | |
| Formula | C9H9NO4 |
| Exact Mass | 195.0531 |
| Average Mass | 195.1721 |
| SMILES | OC(=O)C(C1)Nc(c2)c(cc(O)c(O)2)1 |
| 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
