TPCN00597

Name Melodinine G
Molecular Formula C19H22N2O
Molecular Weight 294.40
CAS Registry Number 1207530-27-5
SMILES CCC12C=Cn3c4c(c5ccccc53)CC[N+]([O-])(CCC1)C42
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Melodinus henryi Seeds 0.000108% J Nat Prod, 2010, 73, 22-26. 10.1021/np900595v
Properties
HBA 3 HBD 0
HeavyAtoms 22 AlogP 4.23
TPSA 27.99 RotatableBonds 1
FractionCSP3 0.47 Rings 5
AromaticRings 2 AliphaticRings 3