taurocholate
- CAS:
- Other names:
- SMILES: C[C@H](CCC(=O)NCC[S](O)(=O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 515.70 | 8 | 5 | 3.84 | 152.54 | 6 | 62 | 0.96 | C26H45NO7S |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| SF_C977 | None | Jan. 1, 2023 |
Bar codes
| Plate barcode | Sample barcode |
|---|---|
PAINS
| Identified PAINS |
|---|
| Not checked |
Supramolecules
| Name | log K | SD | pH | T(°C) | Method | Ref |
|---|---|---|---|---|---|---|
| [mono[6-(9-anthrylformamido)ethyleneamino-6-deoxy]-b-cyclodextrin](1).[taurocholate] | 3.42 | 2.49 | 7.2 | 25.0 | Microcalorimetric titrations | Yu Liu 2004 |
| [mono[6-(9-anthrylformamido)diethylenediamino-6-deoxy]-b-cyclodextrin](1).[taurocholate] | 3.57 | 2.64 | 7.2 | 25.0 | Microcalorimetric titrations | Yu Liu 2004 |
| [mono[6-(9-anthrylformamido)triethylenetriamino-6-deoxy]-b-cyclodextrin](1).[taurocholate] | 3.26 | 2.07 | 7.2 | 25.0 | Microcalorimetric titrations | Yu Liu 2004 |