TPCN04266

Name Loniceroside E
Molecular Formula C53H86O21
Molecular Weight 1059.25
CAS Registry Number 1150265-80-7
SMILES CC1OC(OC2C(OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CCC(OC7OC(CO)C(O)C(O)C7O)C(C)(C)C6CCC5(C)C3(C)CC4)OC(COC3OCC(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Caprifoliaceae Lonicera japonica Aerial parts 0.002820% Chem Pharm Bull (Tokyo) 62(1): 92-96. 10.1248/cpb.c13-00592
Caprifoliaceae Lonicera japonica Buds 0.001600% J Asian Nat Prod Res 10(9-10): 925-929. 10.1080/10286020802217366
Properties
HBA 21 HBD 12
HeavyAtoms 74 AlogP -0.37
TPSA 333.67 RotatableBonds 10
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9