TPCN04580
Name | Lupine |
Molecular Formula | C65H106O32 |
Molecular Weight | 1399.53 |
CAS Registry Number | 1427970-92-0 |
SMILES | C=C(C)C1CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(CCC4C5(C)CCC(OC6OCC(O)C(O)C6OC6OC(C)C(O)C(OC7OC(CO)C(OC8OC(CO)C(O)C(O)C8O)C(O)C7O)C6O)C(C)(CO)C5CCC43C)C12 |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Caprifoliaceae | Lonicera macranthoides | Buds | 0.000225% | Carbohydr Res 370: 76-81. | 10.1016/j.carres.2013.01.019 |
Properties
HBA | 32 | HBD | 19 |
HeavyAtoms | 97 | AlogP | -5.89 |
TPSA | 512.20 | RotatableBonds | 18 |
FractionCSP3 | 0.95 | Rings | 11 |
AromaticRings | 0 | AliphaticRings | 11 |