TPCN02247

[object Object]
Name Songorine
Molecular Formula C22H31NO3
Molecular Weight 357.49
CAS Registry Number 509-24-0
SMILES C=C1C2CC3(C1O)C1CC4C5(C)CCC(O)C4(C1N(CC)C5)C3CC2=O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum nagarum Roots 0.053000% Planta Med 2005; 71: 1073±1076 10.1055/s-2005-873135
Ranunculaceae Aconitum pendulum Roots 0.005000% Nat Prod Bioprospect 9, 419-423 (2019). 10.1007/s13659-019-00227-y
Ranunculaceae Aconitum carmichaeli Roots 0.001200% Nat Prod Res 31, 228-232 (2017). 10.1080/14786419.2016.1219863
Ranunculaceae Aconitum napellus Aerial parts 0.000610% J Nat Prod 62, 701-704 (1999). 10.1021/np980442c
Ranunculaceae Aconitum sinchiangense Whole plants 0.000074% Nat Prod Res 32, 2319-2324 (2018). 10.1080/14786419.2017.1410814
Properties
HBA 4 HBD 2
HeavyAtoms 26 AlogP 2.00
TPSA 60.77 RotatableBonds 1
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6