中文别名 | ;CotinineN-(4-Deoxy-4,5-didehydro)-β-D-glucuronide |
英文别名 | CotinineN-(4-Deoxy-4,5-didehydro)-β-D-glucuronide; |
CAS号 | 146275-15-2 |
SMILES | CN1[C@@H](CCC1=O)c2ccc[n+](c2)[C@@H]3[C@@H]([C@@H](C=C(O3)C(=O)[O-])O)OCopyCopied |
Inchi | InChI=1S/C16H18N2O6/c1-17-10(4-5-13(17)20)9-3-2-6-18(8-9)15-14(21)11(19)7-12(24-15)16(22)23/h2-3,6-8,10-11,14-15,19,21H,4-5H2,1H3/t10-,11+,14+,15-/m0/s1CopyCopied |
InchiKey | DXCAURCQPPWRAO-DRABBMOASA-NCopyCopied |
分子式 Formula | C16H18N2O6 |
分子量 Molecular Weight | 334.32 |
熔点 Melting point | 153 - 156℃ |
溶解度Solubility | Methanol (Slightly), Water (Slightly) |
储藏条件 Storage conditions | Hygroscopic, -20℃ Freezer, Under inert atmosphere |