TPCN04235
![[object Object]](../../static/browser_molecular_png/TPCN04235.png)
| Name | Pithelucoside A |
| Molecular Formula | C86H138O42 |
| Molecular Weight | 1844.01 |
| CAS Registry Number | 1001598-52-2 |
| SMILES | C=CC(C)(CCC=C(CO)C(=O)OC1CC2(C(=O)OC3OC(CO)C(O)C(O)C3OC3OC(C)C(OC4OC(CO)C(O)C4O)C(OC4OC(C)C(O)C(O)C4O)C3O)C(O)CC3(C)C(=CCC4C5(C)CCC(OC6OC(COC7OC(C)C(O)C(O)C7OC7OCC(O)C(O)C7O)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2CC1(C)C)OC1OC(C)C(O)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Fabaceae | Pithecellobium lucidum | Roots | 0.004667% | J Nat Prod 71(1): 41-46. | 10.1021/np0703794 |
Properties
| HBA | 42 | HBD | 23 |
| HeavyAtoms | 128 | AlogP | -6.22 |
| TPSA | 656.34 | RotatableBonds | 26 |
| FractionCSP3 | 0.91 | Rings | 13 |
| AromaticRings | 0 | AliphaticRings | 13 |