TPCN01161
![[object Object]](../../static/browser_molecular_png/TPCN01161.png)
| Name | Melitensin 15-O-beta-D-glucoside |
| Molecular Formula | C21H32O9 |
| Molecular Weight | 428.48 |
| CAS Registry Number | 2096500-52-4 |
| SMILES | C=CC1(C)CC(O)C2C(C)C(=O)OC2C1C(=C)COC1OC(CO)C(O)C(O)C1O |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Asteraceae | Cnicus benedictus | Aerial parts | 0.001683% | Nat Prod Res 31(19): 2211-2217.(2017) | 10.1080/14786419.2017.1295239 |
Properties
| HBA | 9 | HBD | 5 |
| HeavyAtoms | 30 | AlogP | -0.89 |
| TPSA | 145.91 | RotatableBonds | 6 |
| FractionCSP3 | 0.76 | Rings | 3 |
| AromaticRings | 0 | AliphaticRings | 3 |