TPCN04568
![[object Object]](../../static/browser_molecular_png/TPCN04568.png)
| Name | Assamicin III |
| Molecular Formula | C61H96O28 |
| Molecular Weight | 1277.41 |
| CAS Registry Number | 872333-54-5 |
| SMILES | CC=C(C)C(=O)OC1C(C)OC(OC2C(O)C3(COC(C)=O)C(O)CC4(C)C(=CCC5C6(C)CCC(OC7OC(C(=O)O)C(OC8OC(CO)C(O)C(O)C8O)C(O)C7OC7OC(CO)C(O)C(O)C7O)C(C)(CO)C6CCC54C)C3CC2(C)C)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Biebersteiniaceae | Aesculus assamica | Seeds | 0.000250% | Chem Pharm Bull (Tokyo) 53(10): 1310-1313. | 10.1248/cpb.53.1310 |
Properties
| HBA | 28 | HBD | 15 |
| HeavyAtoms | 89 | AlogP | -2.47 |
| TPSA | 446.96 | RotatableBonds | 16 |
| FractionCSP3 | 0.89 | Rings | 9 |
| AromaticRings | 0 | AliphaticRings | 9 |