TPCN01308

Name Crenulatosides E
Molecular Formula C31H50O13
Molecular Weight 630.73
CAS Registry Number 1023755-17-0
SMILES CC(=O)OC1C(OCC2OC(OCC=C(C)CCC=C(C)CCC=C(C)CO)C(O)C(O)C2O)OC(C)C(O)C1OC(C)=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Sapindaceae Guioa villosa Leaves 0.000800% Planta Med 74(1): 55-60.(2008) 10.1055/s-2007-993780
Properties
HBA 13 HBD 5
HeavyAtoms 44 AlogP 1.19
TPSA 190.67 RotatableBonds 15
FractionCSP3 0.74 Rings 2
AromaticRings 0 AliphaticRings 2