TPCN01289

Name Armexin
Molecular Formula C19H24O6
Molecular Weight 348.40
CAS Registry Number 41929-27-5
SMILES C=C1C(=O)OC2C3=C(C)C(OC(C)=O)CC(OC(C)=O)C3(C)CCC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Tanacetum praeteritum Aerial parts 0.000918% Planta Med 62(5): 419-422.(1996) 10.1055/s-2006-957930
Properties
HBA 6 HBD 0
HeavyAtoms 25 AlogP 2.47
TPSA 78.90 RotatableBonds 2
FractionCSP3 0.63 Rings 3
AromaticRings 0 AliphaticRings 3