TPCN01885
| Name | Dihydrophaseic acid 4'-O-[6''-O-(4'''-hydroxy-3''', 5'''-dimethoxy) benzoyl)]-beta-D-glucopyranoside |
| Molecular Formula | C30H40O14 |
| Molecular Weight | 624.64 |
| CAS Registry Number | 2596983-97-8 |
| SMILES | COc1cc(C(=O)OCC2OC(OC3CC4(C)COC(C)(C3)C4(O)C=CC(C)=CC(=O)O)C(O)C(O)C2O)cc(OC)c1O |
| Classify | Sesquiterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rutaceae | Zanthoxylum armatum | Stems | 0.000066% | Nat Prod Res: 1-6.(2019) | 10.1080/14786419.2019.1607332 |
Properties
| HBA | 14 | HBD | 6 |
| HeavyAtoms | 44 | AlogP | 0.67 |
| TPSA | 210.90 | RotatableBonds | 10 |
| FractionCSP3 | 0.60 | Rings | 4 |
| AromaticRings | 1 | AliphaticRings | 3 |