TPCN03360

Name Coreanine A
Molecular Formula C27H37NO6
Molecular Weight 471.59
CAS Registry Number 2412446-32-1
SMILES C=C1CC23CC4C5C6(C)CC(OC(=O)C(C)CC)CC57C2C(O)C1C(OC(C)=O)C3(O)C7N4C6
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum coreanum Roots 0.000275% Chemistry & Biodiversity 17, (2020). 10.1002/cbdv.201900600
Properties
HBA 7 HBD 2
HeavyAtoms 34 AlogP 2.05
TPSA 96.30 RotatableBonds 4
FractionCSP3 0.85 Rings 9
AromaticRings 0 AliphaticRings 9