TPCN02533

Name Hemsleyanine C
Molecular Formula C24H39NO6
Molecular Weight 437.58
CAS Registry Number 1013627-14-9
SMILES CCN1CC2(COC)CCC(OC)C34C5CC6C(OC)CC(O)(C(CC23O)C14)C5C6O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum hemsleyanum Subterraneous stems 0.000800% Arch Pharm Res 30, 1497-1500 (2007). 10.1007/bf02977316
Properties
HBA 7 HBD 3
HeavyAtoms 31 AlogP 0.65
TPSA 91.62 RotatableBonds 5
FractionCSP3 1.00 Rings 6
AromaticRings 0 AliphaticRings 6