TPCN05937
![[object Object]](../../static/browser_molecular_png/TPCN05937.png)
| Name | 3-O-??-D-glucopyranosyl-(1??2)-??-D-glucuronopyranosyl-21-O-acetyl-22-O-angeloyl-R1-barrigenol |
| Molecular Formula | C49H76O19 |
| Molecular Weight | 969.13 |
| CAS Registry Number | 1581304-25-7 |
| SMILES | CC=C(C)C(=O)OC1C(OC(C)=O)C(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)C(O)C(O)C21CO |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apiaceae | Eryngium planum | Roots | 0.012000% | Nat Prod Res . 2014;28(9):653-60 | 10.1080/14786419.2014.895722 |
Properties
| HBA | 19 | HBD | 10 |
| HeavyAtoms | 68 | AlogP | 0.85 |
| TPSA | 308.89 | RotatableBonds | 10 |
| FractionCSP3 | 0.86 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |