TPCN00780

Name 3??-acetonyltabersonine
Molecular Formula C24H28N2O3
Molecular Weight 392.50
CAS Registry Number 126522-37-0
SMILES CCC12C=CC(CC(C)=O)N3CCC4(C(=C(C(=O)OC)C1)Nc1ccccc14)C32
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Melodinus tenuicaudatus Aerial parts 0.000013% Fitoterapia, 2019, 138, 104347. 10.1016/j.fitote.2019.104347
Properties
HBA 5 HBD 1
HeavyAtoms 29 AlogP 3.57
TPSA 58.64 RotatableBonds 4
FractionCSP3 0.50 Rings 5
AromaticRings 1 AliphaticRings 4