TPCN00473

Name Cimicifugolides B
Molecular Formula C11H18O5
Molecular Weight 230.26
CAS Registry Number 1480352-40-6
SMILES COC(CO)C1C(=O)OC(C=C(C)C)C1O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Actaea cimicifuga Roots 0.000236% Planta Med, 2013, 79, 308-311. 10.1055/s-0032-1328127
Properties
HBA 5 HBD 2
HeavyAtoms 16 AlogP -0.14
TPSA 75.99 RotatableBonds 4
FractionCSP3 0.73 Rings 1
AromaticRings 0 AliphaticRings 1