TPCN05299
![[object Object]](../../static/browser_molecular_png/TPCN05299.png)
| Name | Cincholic acid 3b-O-b-D-6-deoxyallopyranosyl-28-O-b-D-glucopyranoside |
| Molecular Formula | C42H66O14 |
| Molecular Weight | 794.98 |
| CAS Registry Number | 126152-35-0 |
| SMILES | CC1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)OC5OC(CO)C(O)C(O)C5O)CCC34C(=O)O)C2(C)C)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Rubiaceae | Ladenbergia hexandra | Barks | 0.006900% | Phytochemistry. 2017. 136, 147-155. | 10.1016/j.phytochem.2017.01.014 |
Properties
| HBA | 14 | HBD | 8 |
| HeavyAtoms | 56 | AlogP | 2.41 |
| TPSA | 232.90 | RotatableBonds | 6 |
| FractionCSP3 | 0.90 | Rings | 7 |
| AromaticRings | 0 | AliphaticRings | 7 |