TPCN01805

Name 6-hydroperoxy-5,6-dihydro-4,5-dehydro-epi-antheindurolide A
Molecular Formula C15H20O6
Molecular Weight 296.32
CAS Registry Number 1072083-49-8
SMILES C=C1C(=O)OCC1C=CC(C)(CC1CC(C)C(=O)O1)OO
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Chloranthaceae Anthemis auriculata Flowers 0.000104% Nat Prod Res 22(10): 907-914.(2008) 10.1080/14786410701642730
Properties
HBA 6 HBD 1
HeavyAtoms 21 AlogP 1.86
TPSA 82.06 RotatableBonds 5
FractionCSP3 0.60 Rings 2
AromaticRings 0 AliphaticRings 2