Glycoside
...
GD101120

Name:
None

Formula:
C21H26O7N2S2

Smiles:
O=C(Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1)c1ccc(N2CCOCC2)s1

Aglycone:
O=C(Nc1ccc(S)cc1)c1ccc(N2CCOCC2)s1

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

Other Identifiers

Properties
HBA: 9 RingCount: 4
HBD: 5 FractionCSP3: 0.48
AlogP: 0.73 Num_rotatable_bonds: 6
MolWt: 482.58 Num_heavy_atoms: 32
TPSA: 131.72 NumAromaticRings: 2

Unique Aglycone
AD42738
Formula: C15H16O2N2S2

Smiles:
O=C(Nc1ccc(S)cc1)c1ccc(N2CCOCC2)s1
HBA: 4 RingCount: 3
HBD: 1 FractionCSP3: 0.27
AlogP: 3.13 Num_rotatable_bonds: 3
MolWt: 320.44 Num_heavy_atoms: 21
TPSA: 41.57 NumAromaticRings: 2

Sugarmoiety
SD00003

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