TPCN00366

Name Scholarisins ??
Molecular Formula C24H28N2O6
Molecular Weight 440.50
CAS Registry Number 1609454-26-3
SMILES CC=C1CN2C3CC45c6ccccc6NC4(O3)C2(OC)CC1C5(COC(C)=O)C(=O)OC
Classify Monoterpenoids
Content
Family Species Part Content (%) Reference DOI
Apocynaceae Alstonia scholaris Leaves 0.000408% Molecules, 2013, 18, 7309-7322. 10.3390/molecules18067309
Properties
HBA 8 HBD 1
HeavyAtoms 32 AlogP 2.15
TPSA 86.33 RotatableBonds 4
FractionCSP3 0.58 Rings 6
AromaticRings 1 AliphaticRings 5