TPCN05658
![[object Object]](../../static/browser_molecular_png/TPCN05658.png)
| Name | Besysaponin C12;Bernardiosides B3 |
| Molecular Formula | C53H86O22 |
| Molecular Weight | 1075.25 |
| CAS Registry Number | 160098-74-8 |
| SMILES | CC1OC(OC2C(O)CC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)OC5OC(C)C(O)C(O)C5OC5OC(C)C(OC6OCC(O)C(O)C6O)C(O)C5O)C(O)CC34C)C2(C)CO)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Bellis sylvestris | Whole plants | 0.275000% | J Nat Prod. 1996 Apr;59(4):355-9. | 10.1021/np9600715. |
| Asteraceae | Bellis sylvestris | Whole plants | 0.028250% | J Nat Prod. 1994 Sep;57(9):1279-82. | 10.1021/np50111a016. |
| Asteraceae | Bellis bernardii | Whole plants | 0.020000% | J Nat Prod. 1996 Oct;59(10):939-43. | 10.1021/np960400t. |
Properties
| HBA | 22 | HBD | 13 |
| HeavyAtoms | 75 | AlogP | -1.40 |
| TPSA | 353.90 | RotatableBonds | 9 |
| FractionCSP3 | 0.94 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |