TPCN06044
![[object Object]](../../static/browser_molecular_png/TPCN06044.png)
| Name | 3-O-??-D-glucuronopyranosyl serjanic acid 28-O-??-D-glucopyranosyl ester |
| Molecular Formula | C43H66O16 |
| Molecular Weight | 838.99 |
| CAS Registry Number | 145826-48-8 |
| SMILES | COC(=O)C1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1 |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Amaranthaceae | Chenopodium quinoa | Seeds | 0.002000% | Phytochemistry . 2008 Jun;69(9):1919-26 | 10.1016/j.phytochem.2008.03.001 |
Properties
| HBA | 16 | HBD | 8 |
| HeavyAtoms | 59 | AlogP | 1.56 |
| TPSA | 259.20 | RotatableBonds | 7 |
| FractionCSP3 | 0.88 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |