TPCN01628

Name 15-isovaleroyloxycostunolide
Molecular Formula C20H28O4
Molecular Weight 332.44
CAS Registry Number 67667-69-0
SMILES C=C1C(=O)OC2C=C(COC(=O)CC(C)C)CCC=C(C)CCC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Cosmos pringlei Roots 0.000250% J Nat Prod 65(7): 1030-1032.(2002) 10.1021/np010615p
Properties
HBA 4 HBD 0
HeavyAtoms 24 AlogP 4.12
TPSA 52.60 RotatableBonds 4
FractionCSP3 0.60 Rings 2
AromaticRings 0 AliphaticRings 2