TPCN03065

Name Mollolide A
Molecular Formula C20H32O8
Molecular Weight 400.47
CAS Registry Number 1438870-75-7
SMILES CC(=O)C1CC(O)C2C(O)C1(CC1OC(=O)C(C)(C)C1(O)CCO)CC2(C)O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ericaceae Rhododendron molle Roots 0.000080% Org Lett 15, 3074-3077 (2013). 10.1021/ol401254e
Properties
HBA 8 HBD 5
HeavyAtoms 28 AlogP -0.47
TPSA 144.52 RotatableBonds 5
FractionCSP3 0.90 Rings 3
AromaticRings 0 AliphaticRings 3