TPCN01372

Name Staphylionoside D
Molecular Formula C19H30O8
Molecular Weight 386.44
CAS Registry Number 663919-93-5
SMILES CC(=O)C=C=C1C(C)(C)CC(OC2OC(CO)C(O)C(O)C2O)CC1(C)O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Solanaceae Datura metel Leaves 0.000600% Nat Prod Res: 1-7.(2019) 10.1080/14786419.2019.1590715
Properties
HBA 8 HBD 5
HeavyAtoms 27 AlogP -0.59
TPSA 136.68 RotatableBonds 4
FractionCSP3 0.79 Rings 2
AromaticRings 0 AliphaticRings 2