TPCN04406
Name | Platycoside E |
Molecular Formula | C69H112O38 |
Molecular Weight | 1549.62 |
CAS Registry Number | 237068-41-6 |
SMILES | CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(COC8OC(COC9OC(CO)C(O)C(O)C9O)C(O)C(O)C8O)C(O)C(O)C7O)C(CO)(CO)C6CCC5(C)C3(C)CC4O)OCC(O)C2O)C(O)C(O)C1OC1OCC(O)C(OC2OCC(O)(CO)C2O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Campanulaceae | Platycodon grandiflorum | Roots | 0.000800% | Molecules 15(12): 8702-8708. | 10.3390/molecules15128702 |
Properties
HBA | 38 | HBD | 23 |
HeavyAtoms | 107 | AlogP | -9.73 |
TPSA | 611.58 | RotatableBonds | 20 |
FractionCSP3 | 0.96 | Rings | 12 |
AromaticRings | 0 | AliphaticRings | 12 |