TPCN05518
Name | Dammar-20S, 25S-epoxy-3b, 12b, 26-triol |
Molecular Formula | C59H96O26 |
Molecular Weight | 1221.39 |
CAS Registry Number | 164178-29-4 |
SMILES | CC1CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(O)C(O)C7O)C6OC6OC(C)C(O)C(O)C6O)C(C)(C)C5CCC43C)C2C1C |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Araliaceae | Panax quinquefolium | Aerial parts | 0.000320% | Nat Prod Res. 2016. 30, 13-19. | 10.1080/14786419.2015.1030403 |
Properties
HBA | 26 | HBD | 15 |
HeavyAtoms | 85 | AlogP | -2.69 |
TPSA | 412.82 | RotatableBonds | 13 |
FractionCSP3 | 0.95 | Rings | 10 |
AromaticRings | 0 | AliphaticRings | 10 |