TPCN05410

Name Polyscioside J
Molecular Formula C49H78O19
Molecular Weight 971.14
CAS Registry Number 2390419-93-7
SMILES COC(=O)C1OC(OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(C(=O)OC5OC(CO)C(O)C(O)C5O)CCC34C)C2(C)C)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Polyscias fruticosa Leaves 0.001397% Nat Prod Res. 2019. 1-6. 10.1080/14786419.2018.1557657.
Araliaceae Polyscias fruticosa Leaves 0.001341% None 10.1080/14786419.2018.1557657
Properties
HBA 19 HBD 10
HeavyAtoms 68 AlogP 0.32
TPSA 301.05 RotatableBonds 9
FractionCSP3 0.92 Rings 8
AromaticRings 0 AliphaticRings 8