TPCN03545
| Name | Proceraosides E |
| Molecular Formula | C101H162O48 |
| Molecular Weight | 2144.36 |
| CAS Registry Number | 2305039-46-5 |
| SMILES | C=CC(C)(O)CCC=C(C)C(=O)OC1C(C)OC(OC(C)(C=C)CCCC(C)C(=O)OC2CC3(C(=O)OC4OC(CO)C(O)C(O)C4OC4OC(C)C(OC5OC(CO)C(O)C5O)C(OC5OC(CO)C(O)C(O)C5O)C4O)CCC4(C)C(=CCC5C6(C)CCC(OC7OC(COC8OCC(O)C(O)C8OC8OCC(O)C(O)C8O)C(O)C(O)C7OC7OC(CO)C(O)C(O)C7O)C(C)(C)C6CCC54C)C3CC2(C)C)C(O)C1O |
| Classify | Triterpenoids |
Content
| Family | Species | Part | Content (%) | Reference | DOI |
|---|---|---|---|---|---|
| Fabaceae | Albizia procera | Barks | 0.002843% | J Nat Prod 81, 2612-2620 (2018). | 10.1021/acs.jnatprod.8b00167 |
Properties
| HBA | 48 | HBD | 25 |
| HeavyAtoms | 149 | AlogP | -5.46 |
| TPSA | 741.56 | RotatableBonds | 36 |
| FractionCSP3 | 0.89 | Rings | 14 |
| AromaticRings | 0 | AliphaticRings | 14 |