TPCN01924

Name Racemosalactones D
Molecular Formula C15H22O4
Molecular Weight 266.34
CAS Registry Number 1425376-82-4
SMILES C=C1CC(O)CC2(C)CC3OC(=O)C(C)(O)C3CC12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Celastraceae Inula racemosa Roots 0.000050% J Nat Prod 76(4): 564-570.(2013) 10.1021/np300742d
Properties
HBA 4 HBD 2
HeavyAtoms 19 AlogP 1.41
TPSA 66.76 RotatableBonds 0
FractionCSP3 0.80 Rings 3
AromaticRings 0 AliphaticRings 3