TPCN04352

Name Ardisicrenoside O
Molecular Formula C53H86O22
Molecular Weight 1075.25
CAS Registry Number 1888485-11-7
SMILES COC1OCC23CCC1(C)CC2C1=CCC2C4(C)CCC(OC5OCC(OC6OC(CO)C(O)C(O)C6OC6OCC(O)C(O)C6O)C(O)C5OC5OC(CO)C(O)C(O)C5O)C(C)(C)C4CCC2(C)C1(C)CC3O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Myrsinaceae Ardisia crenata Roots 0.001214% Nat Prod Res 30(23): 2694-2703. 10.1080/14786419.2016.1146889
Properties
HBA 22 HBD 12
HeavyAtoms 75 AlogP -1.32
TPSA 335.06 RotatableBonds 11
FractionCSP3 0.96 Rings 11
AromaticRings 0 AliphaticRings 11