TPCN00142

Name Bonabiline A
Molecular Formula C18H29NO4
Molecular Weight 323.43
CAS Registry Number 935761-54-9
SMILES CN1C2CCC1CC(OC(=O)C1C(O)C(O)C3CC1C3(C)C)C2
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Convolvulaceae Bonamia spectabilis Roots 0.002708% Planta Med, 2006, 72, 1403-1406. 10.1055/s-2006-951728
Properties
HBA 5 HBD 2
HeavyAtoms 23 AlogP 1.17
TPSA 70.00 RotatableBonds 2
FractionCSP3 0.94 Rings 5
AromaticRings 0 AliphaticRings 5