TPCN02887

Name Excisusin F
Molecular Formula C26H37NO6
Molecular Weight 459.58
CAS Registry Number 1282535-57-2
SMILES C=C1C(=O)C23CCC4C(C)(COC5CCC(=O)N5)C(OC(C)=O)CCC4(C)C2C(O)CC1C3
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Lamiaceae Isodon excisus Aerial parts 0.000181% Bioorg Med Chem Lett 21, 1279-1281 (2011). 10.1016/j.bmcl.2010.11.095
Properties
HBA 7 HBD 2
HeavyAtoms 33 AlogP 2.90
TPSA 101.93 RotatableBonds 4
FractionCSP3 0.81 Rings 5
AromaticRings 0 AliphaticRings 5