TPCN01792

Name Tomenphantopin H
Molecular Formula C25H32O6
Molecular Weight 428.53
CAS Registry Number 1449742-06-6
SMILES C=C(C)C(=O)OC1CC(C)=CC2(OC(C)(C)C(=C)C)C=C(C)C(O2)C2OC(=O)C(=C)C12
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Asteraceae Elephantopus tomentosus Whole plants 0.000114% J Asian Nat Prod Res 14(7): 700-703.(2012) 10.1080/10286020.2012.682153
Properties
HBA 6 HBD 0
HeavyAtoms 31 AlogP 4.33
TPSA 71.06 RotatableBonds 5
FractionCSP3 0.52 Rings 3
AromaticRings 0 AliphaticRings 3