TPCN02839

Name Rabdoternin A
Molecular Formula C20H28O6
Molecular Weight 364.44
CAS Registry Number 128887-80-9
SMILES C=C1C2CCC3C45CCCC(C)(C)C4C(O)C(O)(OC5=O)C3(C1O)C2O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Isodon japonica Leaves 0.000219% Nat Prod Res 27, 1388-1392 (2013). 10.1080/14786419.2012.746339
Properties
HBA 6 HBD 4
HeavyAtoms 26 AlogP 0.72
TPSA 107.22 RotatableBonds 0
FractionCSP3 0.85 Rings 6
AromaticRings 0 AliphaticRings 6