
CAS Number81256-81-7
Synonyms1Hydroxymidazolam-b-D-glucuronide; 1-HydroxyMidazolaM Glucuronide; 1-hydroxymethylmidazolam glucuronide; 1'-Hydroxymidazolam-beta-D-Glucuronide; MFCD09840746
Molecular FormulaC24H21ClFN3O7
Molecular Weight517.891
Purity98.00%
Density1.683g/cm3
Boiling Point788.0±70.0 °C at 760 mmHg
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 81256-81-7 |
| Catalog No. | 2A-1170377 |
| Chinese Name | 1'-羟基咪达唑仑-beta-D-葡糖苷酸 |
| Synonyms | 1Hydroxymidazolam-b-D-glucuronide; 1-HydroxyMidazolaM Glucuronide; 1-hydroxymethylmidazolam glucuronide; 1'-Hydroxymidazolam-beta-D-Glucuronide; MFCD09840746 |
| Molecular Formula | C24H21ClFN3O7 |
| Molecular Weight | 517.891 |
| Purity | 98.00 |
| Density | 1.683g/cm3 |
| Boiling Point | 788.0±70.0 °C at 760 mmHg |
| Application | 1'-Hydroxymidazolam-β-D-glucuronide is a β-D-glucuronic acid that is used as a drug metabolite, human urine metabolite, and human serum metabolite [1]. |
| PubChem ID | 10243418 |
| SMILES | O=C(O)C1OC(OCc2ncc3n2-c2ccc(Cl)cc2C(c2ccccc2F)=NC3)C(O)C(O)C1O |
| InChI | InChI=1S/C24H21ClFN3O7/c25-11-5-6-16-14(7-11)18(13-3-1-2-4-15(13)26)28-9-12-8-27-17(29(12)16)10-35-24-21(32)19(30)20(31)22(36-24)23(33)34/h1-8,19-22,24,30-32H,9-10H2,(H,33,34)/t19-,20-,21+,22-,24+/m0/s1 |
| InChI Key | ICIUMXQTLQXWGL-QMDPOKHVSA-N |
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