TPCN03864
Name | 2alpha,3beta,23-trihydroxyurs-12-en-28-oic acid 3-O-[alpha-L-arabinopyranoside]-28-O-[beta-D-glucopyranosyl(1-->2)-beta-D-glucopy ranosyl] ester |
Molecular Formula | C46H74O18 |
Molecular Weight | 915.08 |
CAS Registry Number | 2410382-27-1 |
SMILES | CC1CCC2(C(=O)OC3OC(CO)C(O)C(O)C3OC3OCC(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OCC(O)C(O)C6O)C(C)(CO)C5CCC43C)C2C1C |
Classify | Triterpenoids |
Content
Family | Species | Part | Content (%) | Reference | DOI |
---|---|---|---|---|---|
Araliaceae | Trevesia palmata | Leaves | 0.000440% | Nat Prod Res, 2019, 1-8. | 10.1080/14786419.2019.1696797 |
Properties
HBA | 18 | HBD | 11 |
HeavyAtoms | 64 | AlogP | -0.78 |
TPSA | 294.98 | RotatableBonds | 8 |
FractionCSP3 | 0.93 | Rings | 8 |
AromaticRings | 0 | AliphaticRings | 8 |