TPCN01338

Name Crenulatosides F
Molecular Formula C31H50O13
Molecular Weight 630.73
CAS Registry Number 1023755-19-2
SMILES CC(=O)OCC(C)=CCCC(C)=CCCC(C)=CCOC1OC(COC2OC(C)C(O)C(O)C2OC(C)=O)C(O)C(O)C1O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Apiaceae Guioa villosa Leaves 0.000686% 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