TPCN04544

Name 3-O-??-D-Glucopyranosyl-(1??3)-??-D-glucopyranosyl-(1??3)-??-Dglucopyranosyloleanolic acid 28-O-??-D-glucopyranoside
Molecular Formula C54H88O23
Molecular Weight 1105.28
CAS Registry Number 1588875-39-1
SMILES CC1(C)CCC2(C(=O)OC3OC(CO)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8O)C7O)C6O)C(C)(C)C5CCC43C)C2C1
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Araliaceae Aralia elata Leaves 0.000300% J Asian Nat Prod Res 15(8): 849-854. 10.1080/10286020.2013.805207
Properties
HBA 23 HBD 14
HeavyAtoms 77 AlogP -2.04
TPSA 374.13 RotatableBonds 12
FractionCSP3 0.94 Rings 9
AromaticRings 0 AliphaticRings 9