TPCN04337
![[object Object]](../../static/browser_molecular_png/TPCN04337.png)
| Name | Sasanquasaponin I |
| Molecular Formula | C60H96O26 |
| Molecular Weight | 1233.40 |
| CAS Registry Number | 1352170-41-2 |
| SMILES | CCCC=CC(=O)OC1CC(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(OC7OC(CO)C(O)C(O)C7OC7OC(C)C(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)C(O)C(O)C12CO |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Theaceae | Camellia sasanqua | Buds | 0.001425% | Chem Pharm Bull (Tokyo) 58(12): 1617-1621. | 10.1248/cpb.58.1617 |
Properties
| HBA | 26 | HBD | 15 |
| HeavyAtoms | 86 | AlogP | -1.62 |
| TPSA | 420.66 | RotatableBonds | 16 |
| FractionCSP3 | 0.90 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |