TPCN02569

Name 15??-hydroxyneoline;15??-hydroxyneoliine;Fuziline
Molecular Formula C24H39NO7
Molecular Weight 453.58
CAS Registry Number 80665-72-1
SMILES CCN1CC2(COC)CCC(O)C34C5CC6C(O)C5C(O)(C(O)C6OC)C(C(OC)C23)C14
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum nagarum Roots 0.002500% Planta Med 2005; 71: 1073±1076 10.1055/s-2005-873135
Ranunculaceae Aconitum carmichaeli Roots 0.000682% Chem Pharm Bull (Tokyo) 60, 144-149 (2012). 10.1248/cpb.60.144
Ranunculaceae Aconitum japonicum Subterraneous stems 0.000084% J Nat Med 72, 230-237 (2018). 10.1007/s11418-017-1139-9
Properties
HBA 8 HBD 4
HeavyAtoms 32 AlogP -0.53
TPSA 111.85 RotatableBonds 5
FractionCSP3 1.00 Rings 6
AromaticRings 0 AliphaticRings 6