TPCN00972
![[object Object]](../../static/browser_molecular_png/TPCN00972.png)
| Name | Hippocrateine I |
| Molecular Formula | C48H52N2O19 |
| Molecular Weight | 960.94 |
| CAS Registry Number | 132185-31-0 |
| SMILES | CC(=O)OCC12C(OC(C)=O)C(OC(C)=O)C3C(OC(C)=O)C14OC3(C)COC(=O)c1cccnc1C(C)C(C)C(=O)OC(C(OC(=O)c1ccc(=O)n(C)c1)C2OC(=O)c1ccccc1)C4(C)O |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Celastraceae | Hippocratea excelsa | Whole plants | 0.005775% | J Nat Prod 53(5): 1212-1219.(1990) | 10.1021/np50071a012 |
Properties
| HBA | 21 | HBD | 1 |
| HeavyAtoms | 69 | AlogP | 2.32 |
| TPSA | 274.75 | RotatableBonds | 9 |
| FractionCSP3 | 0.50 | Rings | 7 |
| AromaticRings | 3 | AliphaticRings | 4 |