TPCN01224

Name 8a-tigloyloxyhirsutinolide
Molecular Formula C20H26O7
Molecular Weight 378.42
CAS Registry Number 188257-41-2
SMILES CC=C(C)C(=O)OC1CC(C)C2(O)CCC(C)(C=C3OC(=O)C(CO)=C31)O2
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Vernonia cinerea Whole plants 0.001250% Chem Pharm Bull (Tokyo) 54(10): 1437-1439.(2006) 10.1248/cpb.54.1437
Properties
HBA 7 HBD 2
HeavyAtoms 27 AlogP 1.89
TPSA 102.29 RotatableBonds 3
FractionCSP3 0.60 Rings 3
AromaticRings 0 AliphaticRings 3