TPCN05536
Name | Phengustifol A |
Molecular Formula | C69H110O29 |
Molecular Weight | 1403.61 |
CAS Registry Number | 2657707-05-4 |
SMILES | C=CC(C)(O)CCC=C(C)C(=O)OC1CC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7OC7OC(CO)C(O)C(O)C7O)C6OC6OC(C)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2CC1(C)C |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Elaeagnaceae | Elaeagnus angustifolia | Flowers | 0.000240% | Molecules. 2020. 25. | 10.3390/molecules25030462 |
Properties
HBA | 29 | HBD | 16 |
HeavyAtoms | 98 | AlogP | -1.36 |
TPSA | 459.35 | RotatableBonds | 19 |
FractionCSP3 | 0.88 | Rings | 10 |
AromaticRings | 0 | AliphaticRings | 10 |