TPCN01210

Name 14-noreudesma-3-hydroxy-3-en-2,9-dione
Molecular Formula C15H20O3
Molecular Weight 248.32
CAS Registry Number 1618669-79-6
SMILES C=C(C)C1CC(=O)C2CC(=O)C(O)=C(C)C2(C)C1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Ixeris chinensis Whole plants 0.001300% Nat Prod Res 28(19): 1579-1582.(2014) 10.1080/14786419.2014.927467
Properties
HBA 3 HBD 1
HeavyAtoms 18 AlogP 2.97
TPSA 54.37 RotatableBonds 1
FractionCSP3 0.60 Rings 2
AromaticRings 0 AliphaticRings 2