TPCN02469

Name Neoline
Molecular Formula C24H39NO6
Molecular Weight 437.58
CAS Registry Number 466-26-2
SMILES CCN1CC2(COC)CCC(O)C34C5CC6C(OC)CC(O)(C5C6O)C(C(OC)C23)C14
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum nagarum Roots 0.015000% Planta Med 2005; 71: 1073±1076 10.1055/s-2005-873135
Ranunculaceae Aconitum sinchiangense Whole plants 0.001034% Nat Prod Res 32, 2319-2324 (2018). 10.1080/14786419.2017.1410814
Ranunculaceae Aconitum hemsleyanum Roots 0.000080% Nat Prod Res, 1-6 (2019). 10.1080/14786419.2018.1560292
Properties
HBA 7 HBD 3
HeavyAtoms 31 AlogP 0.50
TPSA 91.62 RotatableBonds 5
FractionCSP3 1.00 Rings 6
AromaticRings 0 AliphaticRings 6