Glycoside
...
GD113302

Name:
None

Formula:
C28H22O7N2F6

Smiles:
CN(C)c1ccc(NC(=O)[C@H](OC(=O)c2cccc(C(F)(F)F)c2)[C@@H](OC(=O)c2cccc(C(F)(F)F)c2)C(=O)O)cc1

Aglycone:
CN(C)c1ccc(N)cc1.O=Cc1cccc(C(F)(F)F)c1.O=Cc1cccc(C(F)(F)F)c1

Sugarmoiety:
O=C(O)C(OO)C(OO)C(=O)O

Other Identifiers

Properties
HBA: 9 RingCount: 3
HBD: 2 FractionCSP3: 0.21
AlogP: 5.26 Num_rotatable_bonds: 9
MolWt: 612.48 Num_heavy_atoms: 43
TPSA: 122.24 NumAromaticRings: 3

Unique Aglycone
AD43961
Formula: C8H12N2

Smiles:
CN(C)c1ccc(N)cc1
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.25
AlogP: 1.33 Num_rotatable_bonds: 1
MolWt: 136.2 Num_heavy_atoms: 10
TPSA: 29.26 NumAromaticRings: 1
AD44686
Formula: C8H5OF3

Smiles:
O=Cc1cccc(C(F)(F)F)c1
HBA: 1 RingCount: 1
HBD: 0 FractionCSP3: 0.12
AlogP: 2.52 Num_rotatable_bonds: 1
MolWt: 174.12 Num_heavy_atoms: 12
TPSA: 17.07 NumAromaticRings: 1

Sugarmoiety
SD00296

O=C(O)C(OO)C(OO)C(=O)O