Glycoside
...
GD063574

Name:
None

Formula:
C12H23O9NS

Smiles:
CC1(C)C[C@@H]1C(=O)N[C@H]1[C@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]1O

Aglycone:
CC1(C)CC1C(N)=O.COS(O)(O)O

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

Other Identifiers

Properties
HBA: 10 RingCount: 2
HBD: 7 FractionCSP3: 0.92
AlogP: -0.89 Num_rotatable_bonds: 5
MolWt: 357.38 Num_heavy_atoms: 23
TPSA: 168.94 NumAromaticRings: 0

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
AD30608
Formula: C6H11ON

Smiles:
CC1(C)CC1C(N)=O
HBA: 2 RingCount: 1
HBD: 2 FractionCSP3: 0.83
AlogP: 0.52 Num_rotatable_bonds: 1
MolWt: 113.16 Num_heavy_atoms: 8
TPSA: 43.09 NumAromaticRings: 0

Sugarmoiety
SD00017

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