TPCN00423

Name Angustidine
Molecular Formula C19H15N3O
Molecular Weight 301.35
CAS Registry Number 40217-50-3
SMILES Cc1cc2cc3n(c(=O)c2cn1)CCc1c-3[nH]c2ccccc12
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Rubiaceae Nauclea subdita Barks 0.000324% PLoS One, 2014, 9, e87286. 10.1371/journal.pone.0087286
Properties
HBA 4 HBD 1
HeavyAtoms 23 AlogP 3.41
TPSA 50.68 RotatableBonds 0
FractionCSP3 0.16 Rings 5
AromaticRings 4 AliphaticRings 1