Glycoside
...
GD094113

Name:
None

Formula:
C17H23O10N2FS

Smiles:
C[C@]1(C(=O)N[C@H]2[C@@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]2O)CC(c2ccc(F)cc2)=NO1

Aglycone:
CC1(C(N)=O)CC(c2ccc(F)cc2)=NO1.COS(O)(O)O

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 7 FractionCSP3: 0.53
AlogP: -0.21 Num_rotatable_bonds: 6
MolWt: 466.44 Num_heavy_atoms: 31
TPSA: 190.53 NumAromaticRings: 1

Unique Aglycone
AD12993
Formula: CH6O4S

Smiles:
COS(O)(O)O
HBA: 4 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: 0.77 Num_rotatable_bonds: 1
MolWt: 114.12 Num_heavy_atoms: 6
TPSA: 69.92 NumAromaticRings: 0
AD34510
Formula: C11H11O2N2F

Smiles:
CC1(C(N)=O)CC(c2ccc(F)cc2)=NO1
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.27
AlogP: 1.19 Num_rotatable_bonds: 2
MolWt: 222.22 Num_heavy_atoms: 16
TPSA: 64.68 NumAromaticRings: 1

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O