TPCN01710

Name Chololactones H
Molecular Formula C30H36O6
Molecular Weight 492.61
CAS Registry Number 2095256-92-9
SMILES CC1=C2CC3C(CO)C4CC4C3(C)C3C4C5(C)C(CC6=C(C)C(=O)OC64C23OC1=O)C(CO)C1CC15
Classify Sesquiterpenoids
Content
Family Species Part Content (%) Reference DOI
Chloranthaceae Chloranthus holostegius Roots 0.000174% Phytochemistry 137: 117-122.(2017) 10.1016/j.phytochem.2017.02.016
Properties
HBA 6 HBD 2
HeavyAtoms 36 AlogP 3.03
TPSA 93.06 RotatableBonds 2
FractionCSP3 0.80 Rings 9
AromaticRings 0 AliphaticRings 9