Glycoside
...
GD013939

Name:
None

Formula:
C26H33O9N2F

Smiles:
CO[C@H]1[C@H](OC2CCN(c3c(F)cc4c(=O)c(C(=O)O)cn5c4c3CC[C@H]5C)CC2)O[C@@H](CO)[C@@H](O)[C@H]1O

Aglycone:
CC1CCc2c(N3CCC(O)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23

Sugarmoiety:
COC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 5
HBD: 4 FractionCSP3: 0.62
AlogP: 0.79 Num_rotatable_bonds: 6
MolWt: 536.55 Num_heavy_atoms: 38
TPSA: 150.92 NumAromaticRings: 2

Unique Aglycone
AD10333
Formula: C19H21O4N2F

Smiles:
CC1CCc2c(N3CCC(O)CC3)c(F)cc3c(=O)c(C(=O)O)cn1c23
HBA: 6 RingCount: 4
HBD: 2 FractionCSP3: 0.47
AlogP: 2.31 Num_rotatable_bonds: 2
MolWt: 360.39 Num_heavy_atoms: 26
TPSA: 82.77 NumAromaticRings: 2

Sugarmoiety
SD00576

COC1C(O)OC(CO)C(O)C1O