TPCN03363

Name Coreanine D
Molecular Formula C31H35NO7
Molecular Weight 533.62
CAS Registry Number 2412446-36-5
SMILES C=C1CC23CC4C5C6(C)CC(OC(C)=O)CC57C2C(OC(C)=O)C1C(OC(=O)c1ccccc1)C3(O)C7N4C6
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum coreanum Roots 0.000044% None 10.1002/cbdv.201900600
Properties
HBA 8 HBD 1
HeavyAtoms 39 AlogP 2.89
TPSA 102.37 RotatableBonds 4
FractionCSP3 0.65 Rings 10
AromaticRings 1 AliphaticRings 9