Glycoside
...
GD098403

Name:
None

Formula:
C20H39O10N2S

Smiles:
CC(C)(C)OC(=O)N1CCC2(CC[C@@H]([NH2+][C@H]3[C@@H](O)O[C@H](COS(O)(O)O)[C@@H](O)[C@@H]3O)C2)CC1

Aglycone:
CC(C)(C)OC(=O)N1CCC2(CCC([NH3+])C2)CC1.COS(O)(O)O

Sugarmoiety:
OC1OC(O)C([OH2+])C(O)C1O

Other Identifiers

Properties
HBA: 12 RingCount: 3
HBD: 8 FractionCSP3: 0.95
AlogP: 0.08 Num_rotatable_bonds: 5
MolWt: 499.6 Num_heavy_atoms: 33
TPSA: 185.99 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
AD41852
Formula: C14H27O2N2

Smiles:
CC(C)(C)OC(=O)N1CCC2(CCC([NH3+])C2)CC1
HBA: 4 RingCount: 2
HBD: 3 FractionCSP3: 0.93
AlogP: 1.8 Num_rotatable_bonds: 0
MolWt: 255.38 Num_heavy_atoms: 18
TPSA: 57.18 NumAromaticRings: 0

Sugarmoiety
SD03900

OC1OC(O)C([OH2+])C(O)C1O