Glycoside
...
GD081015

Name:
None

Formula:
C16H23O6N5S

Smiles:
CC(=O)N[C@H]1[C@H](OCCn2cc(-c3nc(C)cs3)nn2)O[C@H](CO)[C@@H](O)[C@@H]1O

Aglycone:
Cc1csc(-c2cn(CCO)nn2)n1

Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 4 FractionCSP3: 0.62
AlogP: -1.33 Num_rotatable_bonds: 7
MolWt: 413.46 Num_heavy_atoms: 28
TPSA: 151.85 NumAromaticRings: 2

Unique Aglycone
AD31954
Formula: C8H10ON4S

Smiles:
Cc1csc(-c2cn(CCO)nn2)n1
HBA: 5 RingCount: 2
HBD: 1 FractionCSP3: 0.38
AlogP: 0.7 Num_rotatable_bonds: 3
MolWt: 210.26 Num_heavy_atoms: 14
TPSA: 63.83 NumAromaticRings: 2

Sugarmoiety
SD00014

CC(=O)NC1C(O)OC(CO)C(O)C1O