TPCN06166

Name Hemslonin A
Molecular Formula C42H68O13
Molecular Weight 780.99
CAS Registry Number 72348-82-4
SMILES CC1(C)CCC2(C(=O)OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Anemone flaccida Subterraneous stems 0.000423% J Asian Nat Prod Res . 2014;16(9):910-21 10.1080/10286020.2014.954554
Properties
HBA 13 HBD 8
HeavyAtoms 55 AlogP 2.32
TPSA 215.83 RotatableBonds 6
FractionCSP3 0.93 Rings 7
AromaticRings 0 AliphaticRings 7