TPCN01376

Name 1beta-hydroxy-8alpha-methoxyeremophil-7(11),9-dien-8beta,12-olide
Molecular Formula C16H22O4
Molecular Weight 278.35
CAS Registry Number 849700-45-4
SMILES COC12C=C3C(O)CCC(C)C3(C)CC1=C(C)C(=O)O2
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Senecio aegyptius Aerial parts 0.000600% J Nat Prod 68(3): 439-442.(2005) 10.1021/np049732l
Properties
HBA 4 HBD 1
HeavyAtoms 20 AlogP 2.33
TPSA 55.76 RotatableBonds 1
FractionCSP3 0.69 Rings 3
AromaticRings 0 AliphaticRings 3