TPCN03243
Name | 15-O-beta-d-apiofuranosyl-(1-->2)-beta-d-glucopyranosyl-18-O-beta-d-glucopyranosy l-13(E)-ent-labda-8(9),13(14)-diene-3beta,15,18-triol |
Molecular Formula | C37H62O17 |
Molecular Weight | 778.89 |
CAS Registry Number | 1881241-06-0 |
SMILES | CC(=CCCOC1OC(CO)C(O)C(OC2OCC(O)(CO)C2O)C1O)CC1=C(C)CCC2C1(C)CCC(O)C2(C)COC1OC(CO)C(O)C(O)C1O |
Classify | Diterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Rosaceae | Rubus chingii | Fruits | 0.000010% | Fitoterapia 102, 23-26 (2015). | 10.1016/j.fitote.2015.01.007 |
Properties
HBA | 17 | HBD | 11 |
HeavyAtoms | 54 | AlogP | -2.30 |
TPSA | 277.91 | RotatableBonds | 14 |
FractionCSP3 | 0.89 | Rings | 5 |
AromaticRings | 0 | AliphaticRings | 5 |