TPCN00387

Name Hirsutine
Molecular Formula C22H28N2O3
Molecular Weight 368.48
CAS Registry Number 7729-23-9
SMILES CCC1CN2CCc3c([nH]c4ccccc34)C2CC1C(=COC)C(=O)OC
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Caprifoliaceae Uncaria rhynchophylla Stems 0.000367% Fitoterapia, 2018, 127, 47-55. 10.1016/j.fitote.2018.01.013
Properties
HBA 5 HBD 1
HeavyAtoms 27 AlogP 3.82
TPSA 54.56 RotatableBonds 4
FractionCSP3 0.50 Rings 4
AromaticRings 2 AliphaticRings 2