Glycoside
...
GD100168

Name:
None

Formula:
C21H27O6N3F3

Smiles:
C[NH2+]C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)COC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1C

Aglycone:
Cc1c(Nc2ncccc2C=O)cccc1C(F)(F)F

Sugarmoiety:
C[NH2+]CC(O)C(O)C(O)C(O)COO

Other Identifiers

Properties
HBA: 9 RingCount: 2
HBD: 7 FractionCSP3: 0.43
AlogP: -0.05 Num_rotatable_bonds: 10
MolWt: 474.46 Num_heavy_atoms: 33
TPSA: 148.75 NumAromaticRings: 2

Unique Aglycone
AD42331
Formula: C14H11ON2F3

Smiles:
Cc1c(Nc2ncccc2C=O)cccc1C(F)(F)F
HBA: 3 RingCount: 2
HBD: 1 FractionCSP3: 0.14
AlogP: 3.96 Num_rotatable_bonds: 3
MolWt: 280.25 Num_heavy_atoms: 20
TPSA: 41.99 NumAromaticRings: 2

Sugarmoiety
SD04123

C[NH2+]CC(O)C(O)C(O)C(O)COO