TPCN03038

Name 6-Onicotinoylscutebarbatine G
Molecular Formula C32H36N2O8
Molecular Weight 576.65
CAS Registry Number 1206805-30-2
SMILES CC1=CCC(OC(=O)c2cccnc2)C2C1(C)C(OC(=O)c1cccnc1)C(O)C1(C)OC3(CCC21C)COC(=O)C3
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Scutellaria barbata Whole plants 0.000093% J Asian Nat Prod Res 11, 451-456 (2009). 10.1080/10286020902845652
Properties
HBA 10 HBD 1
HeavyAtoms 42 AlogP 3.84
TPSA 134.14 RotatableBonds 4
FractionCSP3 0.53 Rings 6
AromaticRings 2 AliphaticRings 4