TPCN05578

Name Ardisimamilloside A
Molecular Formula C53H86O23
Molecular Weight 1091.25
CAS Registry Number 308250-08-0
SMILES CC1OC(OC2C(OC3COC(OC4CCC5(C)C(CCC6(C)C5CCC57OC(O)C8(CCC(C)(C=O)CC85)C(O)CC67C)C4(C)C)C(OC4OC(CO)C(O)C(O)C4O)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Myrsinaceae Ardisia mamillata Roots 0.000664% Phytochemistry . 2000 Aug;54(8):817-22 10.1016/s0031-9422(00)00173-4
Primulaceae Lysimachia foenum-graecum Aerial parts 0.000120% Phytochemistry. 2017. 136, 165-174. 10.1016/j.phytochem.2017.01.021
Properties
HBA 23 HBD 13
HeavyAtoms 76 AlogP -2.19
TPSA 363.13 RotatableBonds 11
FractionCSP3 0.98 Rings 10
AromaticRings 0 AliphaticRings 10