TPCN00827

Name 4,21-Secovincanol
Molecular Formula C19H26N2O
Molecular Weight 298.43
CAS Registry Number 2766148-68-7
SMILES CCC12CCCNCCc3c(n(c4ccccc34)C(O)C1)C2
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Kopsia hainanensis Aerial parts 0.000200% Chemistry & Biodiversity 18, (2021). 10.1002/cbdv.202100084
Properties
HBA 3 HBD 2
HeavyAtoms 22 AlogP 3.40
TPSA 37.19 RotatableBonds 1
FractionCSP3 0.58 Rings 4
AromaticRings 2 AliphaticRings 2