TPCN01767

Name Racemosalactones B
Molecular Formula C15H21ClO4
Molecular Weight 300.78
CAS Registry Number 1425376-80-2
SMILES CC1C2=CC3C(CC2(C)CCC1O)OC(=O)C3(O)CCl
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Lauraceae Inula racemosa Roots 0.000130% J Nat Prod 76(4): 564-570.(2013) 10.1021/np300742d
Properties
HBA 4 HBD 2
HeavyAtoms 20 AlogP 1.63
TPSA 66.76 RotatableBonds 1
FractionCSP3 0.80 Rings 3
AromaticRings 0 AliphaticRings 3