TPCN03643
![[object Object]](../../static/browser_molecular_png/TPCN03643.png)
| Name | Reiniosides B |
| Molecular Formula | C61H96O30 |
| Molecular Weight | 1309.41 |
| CAS Registry Number | 167324-06-3 |
| SMILES | CC(=O)OC1C(C)OC(OC(=O)C23CCC(C)(C)CC2C2=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C(=O)O)C5CCC4(C)C2(CO)CC3)C(OC2OC(C)C(OC3OCC(O)C(O)C3O)C(O)C2O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Meliaceae | Melia volkensii | Barks | 0.001440% | Bioorg Med Chem 3, 383-390 (1995). | 10.1016/0968-0896(95)00034-e |
Properties
| HBA | 30 | HBD | 16 |
| HeavyAtoms | 91 | AlogP | -3.94 |
| TPSA | 476.42 | RotatableBonds | 15 |
| FractionCSP3 | 0.92 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |