TPCN02832

Name Straconitine A
Molecular Formula C31H43NO8
Molecular Weight 557.68
CAS Registry Number 2070009-83-3
SMILES CCN1CC2(COC)C(O)CC(O)C34C5CC6C(OC)CC(O)(C5C6OC(=O)c5ccccc5)C(C(OC)C23)C14
Classify Diterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Aconitum fengii Roots 0.000226% J Asian Nat Prod Res 18, 366-370 (2016). 10.1080/10286020.2015.1107545
Properties
HBA 9 HBD 3
HeavyAtoms 40 AlogP 1.34
TPSA 117.92 RotatableBonds 7
FractionCSP3 0.77 Rings 7
AromaticRings 1 AliphaticRings 6