TPCN01849

Name Racemosalactones A
Molecular Formula C15H22O3
Molecular Weight 250.34
CAS Registry Number 1425376-79-9
SMILES C=C1C(=O)OC2CC3(C)CCCC(C)C3(O)CC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Thymelaeaceae Inula racemosa Roots 0.000080% J Nat Prod 76(4): 564-570.(2013) 10.1021/np300742d
Properties
HBA 3 HBD 1
HeavyAtoms 18 AlogP 2.44
TPSA 46.53 RotatableBonds 0
FractionCSP3 0.80 Rings 3
AromaticRings 0 AliphaticRings 3