TPCN01877

Name 2-O-demethyltomenphantopin C
Molecular Formula C20H26O7
Molecular Weight 378.42
CAS Registry Number 2088740-65-0
SMILES C=C(C)C(=O)OC1CC(C)=CC2(O)C=C(C)C(O2)C2OC(=O)C(COC)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Elephantopus mollis Whole plants 0.000068% Phytochemistry 137: 81-86.(2017) 10.1016/j.phytochem.2017.01.020
Properties
HBA 7 HBD 1
HeavyAtoms 27 AlogP 1.66
TPSA 91.29 RotatableBonds 4
FractionCSP3 0.60 Rings 3
AromaticRings 0 AliphaticRings 3