TPCN02721

Name Spiramine H
Molecular Formula C22H33NO3
Molecular Weight 359.51
CAS Registry Number 142750-45-6
SMILES C=C1C2CC(=O)C3(CCC4C5(C)CCCC4(CN(CCO)C5)C3C2)C1O
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum kusnezoffii Roots 0.000341% J Asian Nat Prod Res 1, 87-92 (1998). 10.1080/10286029808039848
Properties
HBA 4 HBD 2
HeavyAtoms 26 AlogP 2.39
TPSA 60.77 RotatableBonds 2
FractionCSP3 0.86 Rings 6
AromaticRings 0 AliphaticRings 6