TPCN00933

Name Zinagrandinolides C
Molecular Formula C21H26O8
Molecular Weight 406.43
CAS Registry Number 918792-05-9
SMILES C=CC1(C)C2OC(=O)C(=C)C(C2OC(C)=O)C(OC(=O)C(C)(C)O)C1C(=C)C=O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Zinnia grandiflora Aerial parts 0.009518% J Nat Prod 69, 1820-1822.(2006) 10.1021/np0603626
Properties
HBA 8 HBD 1
HeavyAtoms 29 AlogP 1.28
TPSA 116.20 RotatableBonds 6
FractionCSP3 0.52 Rings 2
AromaticRings 0 AliphaticRings 2