TPCN01353

Name Eupakirunsins D
Molecular Formula C20H26O6
Molecular Weight 362.42
CAS Registry Number 857502-85-3
SMILES C=C1C(=O)OC2C=C(C)C3(O)CCC(C)(CC(OC(=O)C(C)=CC)C12)O3
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Eupatorium luchuense Leaves 0.000650% J Nat Prod 68(5): 745-750.(2005) 10.1021/np040214k
Properties
HBA 6 HBD 1
HeavyAtoms 26 AlogP 2.57
TPSA 82.06 RotatableBonds 2
FractionCSP3 0.60 Rings 3
AromaticRings 0 AliphaticRings 3