TPCN01738

Name Laggeric acid
Molecular Formula C15H26O4
Molecular Weight 270.37
CAS Registry Number 1620389-75-4
SMILES C=C(C(=O)O)C1CCC(C)(CCCC(C)O)C(O)C1
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Laggera crispata Whole plants 0.000160% J Asian Nat Prod Res 16(3): 318-322.(2014) 10.1080/10286020.2013.867850
Properties
HBA 4 HBD 3
HeavyAtoms 19 AlogP 2.35
TPSA 77.76 RotatableBonds 6
FractionCSP3 0.80 Rings 1
AromaticRings 0 AliphaticRings 1