TPCN04489

Name Scabiostellatoside F
Molecular Formula C70H114O34
Molecular Weight 1499.65
CAS Registry Number 2229823-10-1
SMILES CC1OC(OC2C(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)O)CCC45C)C3(C)C)OCC(O)C2O)C(O)C(OC2OCC(O)C(OC3OC(C)C(OC4OC(CO)C(OC5OC(CO)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C2O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caprifoliaceae Lomelosia stellata Whole plants 0.000459% Phytochemistry 150: 40-49. 10.1016/j.phytochem.2018.03.005
Properties
HBA 34 HBD 19
HeavyAtoms 104 AlogP -4.66
TPSA 530.66 RotatableBonds 18
FractionCSP3 0.96 Rings 12
AromaticRings 0 AliphaticRings 12