TPCN00512

Name Actinodaphnine
Molecular Formula C18H17NO4
Molecular Weight 311.34
CAS Registry Number 517-69-1
SMILES COc1cc2c(cc1O)CC1NCCc3cc4c(c-2c31)OCO4
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Hernandiaceae Illigera aromatica Stems 0.000180% Nat Prod Res, 2019, 1-7. 10.1080/14786419.2019.1614574
Properties
HBA 5 HBD 2
HeavyAtoms 23 AlogP 2.54
TPSA 59.95 RotatableBonds 1
FractionCSP3 0.33 Rings 5
AromaticRings 2 AliphaticRings 3