TPCN05452
![[object Object]](../../static/browser_molecular_png/TPCN05452.png)
| Name | 1 5a-hydroxy-pristimerin |
| Molecular Formula | C68H102O27 |
| Molecular Weight | 1351.54 |
| CAS Registry Number | 1609198-27-7 |
| SMILES | COc1ccc(C=CC(=O)OC2C(OC3COC(OC4C(O)C(C)OC(OC5C(OC6CCC7(C)C(CCC8(C)C7CC=C7C9CC(C)(C)CCC9(C(=O)O)CCC78C)C6(C)C)OCC(O)C5O)C4O)C(O)C3O)OC(COC3OC(C)C(O)C(O)C3O)C(O)C2O)cc1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Celastraceae | Maytenus scutioides | Barks | 0.000667% | Planta Med. 1998. 64, 769-771. | 10.1055/s-2006-957581. |
Properties
| HBA | 27 | HBD | 13 |
| HeavyAtoms | 95 | AlogP | 1.67 |
| TPSA | 407.89 | RotatableBonds | 16 |
| FractionCSP3 | 0.82 | Rings | 11 |
| AromaticRings | 1 | AliphaticRings | 10 |