TPCN00427
![[object Object]](../../static/browser_molecular_png/TPCN00427.png)
| Name | 6''-O-b-d-glucopyranosylipecoside |
| Molecular Formula | C33H45NO17 |
| Molecular Weight | 727.71 |
| CAS Registry Number | 408363-52-0 |
| SMILES | C=CC1C(OC2OC(COC3OC(CO)C(O)C(O)C3O)C(O)C(O)C2O)OC=C(C(=O)OC)C1CC1c2cc(O)c(O)cc2CCN1C(C)=O |
| Classify | Monoterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rubiaceae | Cephaelis acuminata | Roots | 0.000316% | Phytochemistry, 2002, 59, 91-97. | 10.1016/s0031-9422(01)00418-6 |
Properties
| HBA | 18 | HBD | 9 |
| HeavyAtoms | 51 | AlogP | -2.59 |
| TPSA | 274.83 | RotatableBonds | 10 |
| FractionCSP3 | 0.64 | Rings | 5 |
| AromaticRings | 1 | AliphaticRings | 4 |