Glycoside
...
GD093958

Name:
None

Formula:
C17H30O11N4S

Smiles:
CN(C(=O)OC(C)(C)C)c1cc(C(=O)N[C@H]2[C@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]2O)n(C)n1

Aglycone:
CN(C(=O)OC(C)(C)C)c1cc(C(N)=O)n(C)n1.COS(O)(O)O

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 2
HBD: 7 FractionCSP3: 0.71
AlogP: -0.52 Num_rotatable_bonds: 6
MolWt: 498.51 Num_heavy_atoms: 33
TPSA: 216.3 NumAromaticRings: 1

Unique Aglycone
AD12993
Formula: CH6O4S

Smiles:
COS(O)(O)O
HBA: 4 RingCount: 0
HBD: 3 FractionCSP3: 1.0
AlogP: 0.77 Num_rotatable_bonds: 1
MolWt: 114.12 Num_heavy_atoms: 6
TPSA: 69.92 NumAromaticRings: 0
AD36811
Formula: C11H18O3N4

Smiles:
CN(C(=O)OC(C)(C)C)c1cc(C(N)=O)n(C)n1
HBA: 7 RingCount: 1
HBD: 2 FractionCSP3: 0.55
AlogP: 0.89 Num_rotatable_bonds: 2
MolWt: 254.29 Num_heavy_atoms: 18
TPSA: 90.45 NumAromaticRings: 1

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O