TPCN00813

Name Tabernabovines B
Molecular Formula C20H26N2O4
Molecular Weight 358.44
CAS Registry Number 2409958-16-1
SMILES CCC12CCC34N5CCC3(O)c3cccc(OC)c3N4C1OCC5C2O
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Tabernaemontana bovina Leaves 0.000004% Org Lett, 2019, 21, 5938-5942. 10.1021/acs.orglett.9b02060
Properties
HBA 6 HBD 2
HeavyAtoms 26 AlogP 1.39
TPSA 65.40 RotatableBonds 2
FractionCSP3 0.70 Rings 8
AromaticRings 1 AliphaticRings 7