TPCN00386

Name Alstiyunnanenines C
Molecular Formula C21H26N2O3
Molecular Weight 354.45
CAS Registry Number 2229806-52-2
SMILES CC=C1C[N+]2([O-])CCC34c5ccccc5N(C)C3C2CC1C4C(=O)OC
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Alstonia yunnanensis Aerial parts 0.000367% Fitoterapia, 2017, 117, 79-83. 10.1016/j.fitote.2016.12.011
Properties
HBA 5 HBD 0
HeavyAtoms 26 AlogP 2.60
TPSA 52.60 RotatableBonds 1
FractionCSP3 0.57 Rings 5
AromaticRings 1 AliphaticRings 4