TPCN06003
![[object Object]](../../static/browser_molecular_png/TPCN06003.png)
| Name | 3-O-??-L-rhamnopyranosyl- (1??2)-??-D-glucuronopyranosyl-22-O-angeloyl-28-O-acetyl-R1-barrigenol |
| Molecular Formula | C49H76O18 |
| Molecular Weight | 953.13 |
| CAS Registry Number | 907594-46-1 |
| SMILES | CC=C(C)C(=O)OC1C(O)C(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)O)C(O)C(O)C6OC6OC(C)C(O)C(O)C6O)C(C)(C)C5CCC4(C)C3(C)C(O)C(O)C21COC(C)=O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Apiaceae | Eryngium campestre | Roots | 0.003333% | J Nat Prod . 2006 Jul;69(7):1105-8 | 10.1021/np060101w |
Properties
| HBA | 18 | HBD | 9 |
| HeavyAtoms | 67 | AlogP | 1.88 |
| TPSA | 288.66 | RotatableBonds | 9 |
| FractionCSP3 | 0.86 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |