TPCN00637

Name Sumadain C
Molecular Formula C25H26O4
Molecular Weight 390.48
CAS Registry Number 1160934-84-8
SMILES CC(C)C1C=CC2(C)Oc3c(C(=O)C=Cc4ccccc4)c(O)cc(O)c3C2C1
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Zingiberaceae Alpinia katsumadai Seeds 0.000075% Bioorg Med Chem Lett, 2009, 19, 2728-2730. 10.1016/j.bmcl.2009.03.117
Properties
HBA 4 HBD 2
HeavyAtoms 29 AlogP 5.46
TPSA 66.76 RotatableBonds 4
FractionCSP3 0.32 Rings 4
AromaticRings 2 AliphaticRings 2