???kuaisusuoyin???- 1.Compound Report
- 2.Properties
- 3.Structure and Representation
- 4.External Links
- 5.Substance of the Compound
- 6.Linked
- 7.ADMET
Compound Report
| Compound ID | 8 |  |
| CAS Number | 77943-54-5 | |
| Generic Name | Zizyphus saponin III | |
| Is Public | false | |
| Synonyms | ||
| Ceate Date | ||
| Comments | ||
| Refs | ||
| Catalogues |
Properties
| Molecular Weight | Abs Weight | Rotatable Bonds | HB Acceptors | HB Donors | LogP | TPSA | Formal Charge |
| 1045.21076 | 1045.21076 | 166 | 0 | 0 | -0.5424 | 314.83 | 0.0 |
Structure and Representation
| Molecular Formula | C52H84O21 |
| Iupac Name | |
| SMILES | [C@]123C4(C(C5(C(C(C(O[C@H]6[C@@H]([C@@H](O[C@H]7[C@@H]([C@@H]([C@@H]([C@H](O7)CO)O)O)O[C@H]7[C@@H]([C@@H]([C@@H](CO7)O)O)O)[C@H](CO6)O)O[C@H]6[C@@H]([C@@H]([C@@H]([C@H](O6)C)O)O)O)CC5)(C)C)CC4)C)CCC1C1[C@](C2)(OC(C[C@@]1(O)C)C=C(C)C)OC3)C |
| Standard InChI | |
| Standard InChI Key | |
| Metling_Point | |
| Character | |
| Optical_Rotation | |
| Mol Files | Download mol File Download mol2 File |
| 2D Structure Viewer | Click Here to View 2D Structure |
| 3D Structure Viewer | Click Here to View 3D Structure |
External Links
| External Links | chemmapper |
Substance Information
| substance | 5 |
Linked
| ???xiangguanfangji??? | |
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| ???xiangguanzhiwu??? | |
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| ???xiangguanbabiao??? | |
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ADMET
