TPCN04244
![[object Object]](../../static/browser_molecular_png/TPCN04244.png)
| Name | Isoorientin-2??-glucoside |
| Molecular Formula | C27H30O16 |
| Molecular Weight | 610.52 |
| CAS Registry Number | 55196-48-0 |
| SMILES | O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c(C3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)c(O)c12 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Caryophyllaceae | Dianthus chinensis | Aerial parts | 0.004167% | Phytochemistry 35(3): 751-756. | 10.1016/s0031-9422(00)90599-5 |
Properties
| HBA | 16 | HBD | 11 |
| HeavyAtoms | 43 | AlogP | -2.38 |
| TPSA | 280.43 | RotatableBonds | 6 |
| FractionCSP3 | 0.44 | Rings | 5 |
| AromaticRings | 3 | AliphaticRings | 2 |