TPCN04474
![[object Object]](../../static/browser_molecular_png/TPCN04474.png)
| Name | Protojujuboside B1 |
| Molecular Formula | C58H96O27 |
| Molecular Weight | 1225.38 |
| CAS Registry Number | 259196-94-6 |
| SMILES | CC(C)=CC(CC(C)(O)C1C(=O)CC2(CO)C1CCC1C3(C)CCC(OC4OCC(O)C(OC5OC(CO)C(O)C(O)C5OC5OCC(O)C(O)C5O)C4OC4OC(C)C(O)C(O)C4O)C(C)(C)C3CCC12C)OC1OC(CO)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rhamnaceae | Ziziphus jujuba | Seeds | 0.000500% | Chem Pharm Bull (Tokyo) 47(12): 1744-1748. | 10.1248/cpb.47.1744 |
Properties
| HBA | 27 | HBD | 16 |
| HeavyAtoms | 85 | AlogP | -3.92 |
| TPSA | 433.05 | RotatableBonds | 17 |
| FractionCSP3 | 0.95 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |