Glycoside
...
GD100355

Name:
None

Formula:
C23H29O9NF

Smiles:
CC(=O)OC[C@H]1O[C@@H](OC(C)=O)[C@H]([NH2+][C@H]2Cc3cccc(F)c3C2)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:
COC(C)=O.[NH3+]C1Cc2cccc(F)c2C1

Sugarmoiety:
CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1[OH2+]

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 2 FractionCSP3: 0.57
AlogP: -0.06 Num_rotatable_bonds: 7
MolWt: 482.48 Num_heavy_atoms: 34
TPSA: 131.04 NumAromaticRings: 1

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD26696
Formula: C9H11NF

Smiles:
[NH3+]C1Cc2cccc(F)c2C1
HBA: 1 RingCount: 2
HBD: 3 FractionCSP3: 0.33
AlogP: 0.53 Num_rotatable_bonds: 0
MolWt: 152.19 Num_heavy_atoms: 11
TPSA: 27.64 NumAromaticRings: 1

Sugarmoiety
SD04070

CC(=O)OC1OC(O)C(OC(C)=O)C(OC(C)=O)C1[OH2+]