TPCN00605

Name N-methylactinodaphnine
Molecular Formula C19H19NO4
Molecular Weight 325.36
CAS Registry Number 5890-28-8
SMILES COc1cc2c(cc1O)CC1c3c(cc4c(c3-2)OCO4)CCN1C
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Hernandiaceae Illigera aromatica Stems 0.000102% Nat Prod Res, 2019, 1-7. 10.1080/14786419.2019.1614574
Properties
HBA 5 HBD 1
HeavyAtoms 24 AlogP 2.88
TPSA 51.16 RotatableBonds 1
FractionCSP3 0.37 Rings 5
AromaticRings 2 AliphaticRings 3