TPCN00939

Name 1-epimer
Molecular Formula C30H44O4
Molecular Weight 468.68
CAS Registry Number 1107632-01-8
SMILES CC(C)=CCCC(C)C1C=CC2(C(=O)O)C(C=C(C)C3CCC(C(=O)O)CC3)C=C(C)CC2C1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Meiogyne cylindrocarpa Leaves 0.008750% J Nat Prod 72(3): 480-483.(2009) 10.1021/np8006292
Properties
HBA 4 HBD 2
HeavyAtoms 34 AlogP 7.44
TPSA 74.60 RotatableBonds 8
FractionCSP3 0.67 Rings 3
AromaticRings 0 AliphaticRings 3