TPCN00119

Name Hirsutanine D
Molecular Formula C21H24N2O6
Molecular Weight 400.43
CAS Registry Number 2134119-78-9
SMILES COC(=O)C1=COC(C)C2CN(CCC3(O)C(=O)Nc4ccccc43)C(=O)CC12
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Rubiaceae Uncaria hirsuta Stems 0.003900% Fitoterapia, 2017, 116, 85-92. 10.1016/j.fitote.2016.11.013
Properties
HBA 8 HBD 2
HeavyAtoms 29 AlogP 1.16
TPSA 105.17 RotatableBonds 4
FractionCSP3 0.48 Rings 4
AromaticRings 1 AliphaticRings 3