TPCN02690

Name Epinodosin
Molecular Formula C20H26O6
Molecular Weight 362.42
CAS Registry Number 20086-60-6
SMILES C=C1C(=O)C23CC1CC(O)C2C12COC(O)C1C(C)(C)CCC2OC3=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Isodon japonica Leaves 0.000384% Nat Prod Res 27, 1388-1392 (2013). 10.1080/14786419.2012.746339
Lamiaceae Isodon henryi Aerial parts 0.000050% Nat Prod Res, 1-7 (2019). 10.1080/14786419.2019.1675067
Properties
HBA 6 HBD 2
HeavyAtoms 26 AlogP 1.20
TPSA 93.06 RotatableBonds 0
FractionCSP3 0.80 Rings 5
AromaticRings 0 AliphaticRings 5