TPCN01422

Name Rhizantholide B
Molecular Formula C15H18O5
Molecular Weight 278.30
CAS Registry Number 2245696-43-7
SMILES C=C1C(=O)OC2C1C(O)CC1(CO)OC3CC1C2C3=C
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Centaurea rhizantha Whole plants 0.000500% Nat Prod Res 33(14): 2016-2023.(2019) 10.1080/14786419.2018.1483926
Properties
HBA 5 HBD 2
HeavyAtoms 20 AlogP 0.17
TPSA 75.99 RotatableBonds 1
FractionCSP3 0.67 Rings 4
AromaticRings 0 AliphaticRings 4