BMMCACCHk010
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 : BMMC mono- or assembled cycle 単、複合環 : BMMCAC aliphatic cycle 脂肪族環 (47 pages) : BMMCACCH cyclohexane シクロヘキサン (22 pages)
IDs and Links | |
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LipidBank | [1] |
LipidMaps | [2] |
CAS | 10534-44-8 |
KEGG | C00944 |
KNApSAcK | |
CDX file | |
MOL file | BMMCACCHk010.mol |
3-Dehydroquinic acid | |
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Structural Information | |
Systematic Name | 1,3,4-Trihydroxy-5-oxocyclohexane-1-carboxylic acid |
Common Name |
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Symbol | |
Formula | C7H10O6 |
Exact Mass | 190.0477 |
Average Mass | 190.1507 |
SMILES | O[C@H](C1)[C@H](O)C(=O)C[C@@](O)1C(O)=O |
Physicochemical Information | |
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Optical Rotation | |
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Spectral Information | |
Mass Spectra | |
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Related Atomic Mappings, Enzymes, and Pathways