Glycoside
...
GD013423

Name:
None

Formula:
C25H30O11N2FCl

Smiles:
Cc1onc(-c2c(F)cccc2Cl)c1C(=O)N[C@H]1[C@H](O)[C@@H](O)[C@@H](CO)O[C@H]1O[C@@H]1C[C@](O)(CO)C[C@H](O)[C@H]1O

Aglycone:
Cc1onc(-c2c(F)cccc2Cl)c1C(N)=O.OCC1(O)CC(O)C(O)C(O)C1

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 8 FractionCSP3: 0.58
AlogP: -1.4 Num_rotatable_bonds: 7
MolWt: 576.96 Num_heavy_atoms: 39
TPSA: 215.2 NumAromaticRings: 2

Unique Aglycone
AD03790
Formula: C7H14O5

Smiles:
OCC1(O)CC(O)C(O)C(O)C1
HBA: 5 RingCount: 1
HBD: 5 FractionCSP3: 1.0
AlogP: -2.41 Num_rotatable_bonds: 1
MolWt: 178.18 Num_heavy_atoms: 12
TPSA: 101.15 NumAromaticRings: 0
AD10018
Formula: C12H8O2N2FCl

Smiles:
Cc1onc(-c2c(F)cccc2Cl)c1C(N)=O
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.09
AlogP: 2.54 Num_rotatable_bonds: 2
MolWt: 254.65 Num_heavy_atoms: 17
TPSA: 69.12 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O