TPCN01193

Name 8alpha-(4'-acetoxymethacryloyloxy)-3alpha,9beta-dihydroxy-1(10)E,4Z,11(13)-germac ratrien-12,6alpha-olide
Molecular Formula C21H26O8
Molecular Weight 406.43
CAS Registry Number 392680-46-5
SMILES C=C(COC(C)=O)C(=O)OC1C(O)C(C)=CCC(O)C(C)=CC2OC(=O)C(=C)C21
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Montanoa tomentosa Aerial parts 0.001429% Planta Med 67, 774-776.(2001) 10.1055/s-2001-18362
Properties
HBA 8 HBD 2
HeavyAtoms 29 AlogP 1.13
TPSA 119.36 RotatableBonds 4
FractionCSP3 0.48 Rings 2
AromaticRings 0 AliphaticRings 2