TPCN01006

Name (4S,6R,7S,8S,10R,11S)-1-oxo-3,10-epoxy-8-angeloyloxygermacra-2-en-6(12)-olide
Molecular Formula C20H26O6
Molecular Weight 362.42
CAS Registry Number 540733-00-4
SMILES CC=C(C)C(=O)OC1CC2(C)OC(=CC2=O)C(C)CC2OC(=O)C(C)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Lychnophora ericoides Leaves 0.004175% J Nat Prod 66(5): 693-695.(2003) 10.1021/np020314v
Properties
HBA 6 HBD 0
HeavyAtoms 26 AlogP 2.71
TPSA 78.90 RotatableBonds 2
FractionCSP3 0.65 Rings 3
AromaticRings 0 AliphaticRings 3