TPCN00601

Name ??-yohimbine
Molecular Formula C21H26N2O3
Molecular Weight 354.45
CAS Registry Number 131-03-3
SMILES COC(=O)C1C(O)CCC2CN3CCc4c([nH]c5ccccc45)C3CC21
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Paeoniaceae Rauvolfia yunnanensis Whole plants 0.000106% Molecules, 2019, 24. 10.3390/molecules24244574
Properties
HBA 5 HBD 2
HeavyAtoms 26 AlogP 2.65
TPSA 65.56 RotatableBonds 1
FractionCSP3 0.57 Rings 5
AromaticRings 2 AliphaticRings 3