TPCN05947
![[object Object]](../../static/browser_molecular_png/TPCN05947.png)
| Name | 3-O-??-D-glucopyranosyl-(1??2)-??-L-arabinopyranosyl-echinocystic acid 28-O-??-L-rhamnopyranosyl-(1??4)-??-D-glucopyranosyl(1??6)-??-D-glucopyranoside |
| Molecular Formula | C59H96O27 |
| Molecular Weight | 1237.39 |
| CAS Registry Number | 384362-23-6 |
| SMILES | CC1OC(OC2C(CO)OC(OCC3OC(OC(=O)C45CCC(C)(C)CC4C4=CCC6C7(C)CCC(OC8OCC(O)C(O)C8OC8OC(CO)C(O)C(O)C8O)C(C)(C)C7CCC6(C)C4(C)CC5O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Berberidaceae | Caulophyllum thalictroides | Roots | 0.009000% | J Agric Food Chem . 2001 Dec;49(12):5969-74 | 10.1021/jf010814e |
Properties
| HBA | 27 | HBD | 16 |
| HeavyAtoms | 86 | AlogP | -3.57 |
| TPSA | 433.05 | RotatableBonds | 13 |
| FractionCSP3 | 0.95 | Rings | 10 |
| AromaticRings | 0 | AliphaticRings | 10 |