TPCN05666

Name Ethyl leptauloside B
Molecular Formula C59H92O25
Molecular Weight 1201.36
CAS Registry Number 2170848-96-9
SMILES CC=C(C)C(=O)OC1CC(C)(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(=O)OCC)C(O)C(OC7OCC(O)C(O)C7OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(O)C6O)C(C)(C=O)C5CCC4(C)C3(C)CC(O)C12CO
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Cardiopteridaceae Leptaulus citroides Roots 0.093333% Nat Prod Bioprospect. 2016 Feb;6(1):31-9. 10.1007/s13659-015-0083-1.
Properties
HBA 25 HBD 12
HeavyAtoms 84 AlogP -1.08
TPSA 386.27 RotatableBonds 15
FractionCSP3 0.88 Rings 9
AromaticRings 0 AliphaticRings 9