TPCN00748

Name Scholarisines F
Molecular Formula C21H24N2O4
Molecular Weight 368.43
CAS Registry Number 1236196-10-3
SMILES CC=C1CN2C3CC45c6ccccc6NC4(O3)C2(OC)CC1C5C(=O)OC
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Alstonia scholaris Barks 0.000027% Planta Med, 2009, 75, 1537-1541. 10.1055/s-0029-1185900
Properties
HBA 6 HBD 1
HeavyAtoms 27 AlogP 2.22
TPSA 60.03 RotatableBonds 2
FractionCSP3 0.57 Rings 6
AromaticRings 1 AliphaticRings 5