TPCN01270

Name 1beta,10beta-epoxy-8alpha-methoxyeremophil-7(11)-en-8beta,12-olide
Molecular Formula C16H22O4
Molecular Weight 278.35
CAS Registry Number 108853-38-9
SMILES COC12CC34OC3CCC(C)C4(C)CC1=C(C)C(=O)O2
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Senecio aegyptius Aerial parts 0.001000% J Nat Prod 68(3): 439-442.(2005) 10.1021/np049732l
Properties
HBA 4 HBD 0
HeavyAtoms 20 AlogP 2.57
TPSA 48.06 RotatableBonds 1
FractionCSP3 0.81 Rings 4
AromaticRings 0 AliphaticRings 4