TPCN04627

Name 3-O-??-L-Arabinopyranosyl(1??3)-??-L-rhamnopyranosyl-(1 ! 2)[??-L-rhamnopyranosyl-(1??4)]-??-Dglucopyranosyl gypsogenin 28-O-??-Dglucopyranosyl-(1??6)-??-Dglucopyranosyl ester
Molecular Formula C65H104O31
Molecular Weight 1381.52
CAS Registry Number 2568015-33-6
SMILES CC1OC(OC2C(CO)OC(OC3CCC4(C)C(CCC5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)OC6OC(COC7OC(CO)C(O)C(O)C7O)C(O)C(O)C6O)CCC45C)C3(C)C=O)C(OC3OC(C)C(O)C(OC4OCC(O)C(O)C4O)C3O)C2O)C(O)C(O)C1O
Classify Triterpenoids
Content
Family Species Part Content (%) Reference DOI
Ranunculaceae Anemone taipaiensis Aerial parts 0.000173% J Asian Nat Prod Res 17(5): 576-585. 10.1080/10286020.2015.1043903
Properties
HBA 31 HBD 17
HeavyAtoms 96 AlogP -4.51
TPSA 488.81 RotatableBonds 16
FractionCSP3 0.94 Rings 11
AromaticRings 0 AliphaticRings 11