TPCN06037
Name | 3-O-??-D-glucopyranosyl (1??4)-??-D-fucopyranosyl (22S,24Z)-cycloart-24-en-3??,22,26,30-tetraol 26-O-??-D-glucopyranoside |
Molecular Formula | C48H80O18 |
Molecular Weight | 945.15 |
CAS Registry Number | 1434133-48-8 |
SMILES | CC(=CCC(O)C(C)C1CCC2(C)C3CCC4C(C)(CO)C(OC5OC(C)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)CCC45CC35CCC12C)COC1OC(CO)C(O)C(O)C1O |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Ranunculaceae | Thalictrum fortunei | Whole plants | 0.002157% | Carbohydr Res . 2017 Jun 5;445:1-6 | 10.1016/j.carres.2017.03.019 |
Properties
HBA | 18 | HBD | 12 |
HeavyAtoms | 66 | AlogP | -0.42 |
TPSA | 298.14 | RotatableBonds | 14 |
FractionCSP3 | 0.96 | Rings | 8 |
AromaticRings | 0 | AliphaticRings | 8 |