TPCN01903

Name Molephantin B
Molecular Formula C20H24O6
Molecular Weight 360.41
CAS Registry Number 2089037-00-1
SMILES C=C1CC(=O)C=C(C)CC(OC(=O)C(C)=CC)C2C(=C)C(=O)OC2C1O
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Lauraceae Elephantopus mollis Whole plants 0.000057% Phytochemistry 137: 81-86.(2017) 10.1016/j.phytochem.2017.01.020
Properties
HBA 6 HBD 1
HeavyAtoms 26 AlogP 2.19
TPSA 89.90 RotatableBonds 2
FractionCSP3 0.45 Rings 2
AromaticRings 0 AliphaticRings 2