TPCN02960

Name Jiufengdine
Molecular Formula C36H52N2O9
Molecular Weight 656.82
CAS Registry Number 486429-07-6
SMILES CCC(C)C(=O)OC1C2CC3C1C(O)(CC2OC)C1(O)C(OC)C2C4(COC(=O)c5ccccc5N)CCC(OC)C32C1N(CC)C4
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Delphinium potaninii Roots 0.000138% Chem Pharm Bull (Tokyo) 50, 1265-1267 (2002). 10.1248/cpb.50.1265
Properties
HBA 11 HBD 4
HeavyAtoms 47 AlogP 2.66
TPSA 150.01 RotatableBonds 10
FractionCSP3 0.78 Rings 7
AromaticRings 1 AliphaticRings 6