TPCN02400

Name Chloride
Molecular Formula C22H34NO2+
Molecular Weight 344.52
CAS Registry Number 4758-99-0
SMILES C=C1C2CCC3(CCC4C5(C)CCCC4(C=[N+](CCO)C5)C3C2)C1O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum orochryseum Aerial parts 0.001690% J Nat Prod 70, 1808-1811 (2007). 10.1021/np070266k
Properties
HBA 3 HBD 2
HeavyAtoms 25 AlogP 3.00
TPSA 43.47 RotatableBonds 2
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6