cholate
- CAS:
- Other names:
- SMILES: C[C@H](CCC(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 |
---|---|---|---|---|---|---|---|---|
408.57 | 5 | 4 | 3.45 | 97.99000000000001 | 4 | 22 | 0.96 | C24H40O5 |
Availability
Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
---|---|---|---|---|---|---|
SF_C975 | None | Jan. 1, 2023 |
Bar codes
Plate barcode | Sample barcode |
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PAINS
Identified PAINS |
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Not checked |
Supramolecules
Name | log K | SD | pH | T(°C) | Method | Ref |
---|---|---|---|---|---|---|
[mono[6-(9-anthrylformamido)ethyleneamino-6-deoxy]-b-cyclodextrin](1).[cholate] | 4.07 | 2.20 | 7.2 | 25.0 | Microcalorimetric titrations | Yu Liu 2004 |
[mono[6-(9-anthrylformamido)diethylenediamino-6-deoxy]-b-cyclodextrin](1).[cholate] | 4.28 | 2.45 | 7.2 | 25.0 | Microcalorimetric titrations | Yu Liu 2004 |
[mono[6-(9-anthrylformamido)triethylenetriamino-6-deoxy]-b-cyclodextrin](1).[cholate] | 4.07 | 2.38 | 7.2 | 25.0 | Microcalorimetric titrations | Yu Liu 2004 |