TPCN00620

Name Scholarisines E
Molecular Formula C21H24N2O5
Molecular Weight 384.43
CAS Registry Number 1236196-08-9
SMILES COC(=O)C1C2CC(N=CC23OC3C)C23Nc4ccccc4C12CC(OC)O3
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Alstonia scholaris Barks 0.000087% Planta Med, 2009, 75, 1537-1541. 10.1055/s-0029-1185900
Properties
HBA 7 HBD 1
HeavyAtoms 28 AlogP 1.86
TPSA 81.68 RotatableBonds 2
FractionCSP3 0.62 Rings 6
AromaticRings 1 AliphaticRings 5